Reference/CAS 7722-84-1
type: UnificationXref
id: 7722-84-1
db: CAS

Dihydrobiopterin
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 64277
xref: Reference/ChemSpider 247
xref: Reference/HMDB HMDB0000038
xref: Reference/KEGG Compound C02953
xref: Reference/BioCyc BIOPTERIN
xref: Reference/CAS 6779-87-9
xref: Reference/PubChem-compound 252
chemical formula: C9H13N5O3
molecular weight: 239.10184
structure: ChemicalStructure/PW C000027

Reference/ChemSpider 937
type: UnificationXref
id: 937
db: ChemSpider

BiologicalState789
type: BioSource
cell type: Neuron
xref: Reference/TAXONOMY 9606
name: Homo sapiens, Brain, Neuron
tissue: Brain

Reference/ChEBI CHEBI 16134
type: UnificationXref
id: CHEBI:16134
db: ChEBI

Catechol O-methyltransferase
type: ProteinReference
xref: Reference/UniProt P21964
organism: BiologicalState789

Compound/PW C000749 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: S-Adenosylhomocysteine
stoichiometric coefficient: 1.0

direct_interaction
type: InteractionVocabulary

Reference/HMDB HMDB0003125
type: UnificationXref
id: HMDB0003125
db: HMDB

Ammonia
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: Ammonia

Tyrosine 3-monooxygenase
type: ProteinReference
xref: Reference/UniProt P07101
organism: BiologicalState789

Compound/PW C000103 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Tyrosine
stoichiometric coefficient: 1.0

ChemicalStructure/PW C001420
type: ChemicalStructure
structure format: SMILES
structure data: O

ChemicalStructure/PW C001783
type: ChemicalStructure
structure format: SMILES
structure data: OO

Reference/GENE ONTOLOGY GO 0070382
type: UnificationXref
id: GO:0070382
db: GENE ONTOLOGY

Compound/PW C000052 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Dopamine
stoichiometric coefficient: 1.0

Ammonia
type: SmallMoleculeReference
xref: Reference/BioCyc AMMONIA
xref: Reference/CAS 7664-41-7
xref: Reference/HMDB HMDB0000051
xref: Reference/PubChem-compound 222
xref: Reference/KEGG Compound C00014
xref: Reference/ChEBI CHEBI 16134
xref: Reference/ChemSpider 217
chemical formula: H3N
molecular weight: 17.026548
structure: ChemicalStructure/PW C000035

L-Tyrosine
type: SmallMolecule
cellular location: Cytosol
entity reference: L-Tyrosine

Reference/HMDB HMDB0001185
type: UnificationXref
id: HMDB0001185
db: HMDB

Compound/PW C000019 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Tetrahydrobiopterin
stoichiometric coefficient: 1.0

TransportCatalysis5932
type: Catalysis
controller: Sodium-dependent dopamine transporter
controlled: Transport15986
control type: ACTIVATION

Compound/PW C001065 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxygen
stoichiometric coefficient: 1.0

Brain
type: TissueVocabulary
xref: Reference/BRENDA TISSUE ONTOLOGY BTO 0000142

Reference/ChemSpider 5833
type: UnificationXref
id: 5833
db: ChemSpider

Reference/UniProt Q01959
type: UnificationXref
id: Q01959
db: UniProt

Compound/PW C001065 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxygen
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0000538
type: UnificationXref
id: HMDB0000538
db: HMDB

Reference/CAS 554-52-9
type: UnificationXref
id: 554-52-9
db: CAS

Reference/PubChem-compound 1125
type: UnificationXref
id: 1125
db: PubChem-compound

Reference/BioCyc ATP
type: UnificationXref
id: ATP
db: BioCyc

Rasagiline
type: SmallMolecule
cellular location: Synapse
entity reference: Rasagiline

Amine oxidase [flavin-containing] B
type: ProteinReference
xref: Reference/UniProt P27338
organism: BiologicalState789

Reference/ChemSpider 247
type: UnificationXref
id: 247
db: ChemSpider

Reference/UniProt P21964
type: UnificationXref
id: P21964
db: UniProt

ChemicalStructure/PW C000103
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CC1=CC=C(O)C=C1)C(O)=O

Aromatic-L-amino-acid decarboxylase
type: ProteinReference
xref: Reference/UniProt P20711
organism: BiologicalState789

Reference/KEGG Compound C05581
type: UnificationXref
id: C05581
db: KEGG Compound

Reference/ChemSpider 559142
type: UnificationXref
id: 559142
db: ChemSpider

Rasagiline Action Pathway
type: Pathway
pathway order: PathwaySubPathway/121425
pathway order: PathwayEnzymeReaction/2536623
pathway order: PathwayTransport/2536629
pathway order: PathwayEnzymeReaction/2536622
pathway order: PathwayTransport/2536628
pathway order: PathwayTransport/2536848
pathway order: PathwayEnzymeReaction/2536621
pathway order: PathwayEnzymeReaction/2536625
pathway order: PathwayEnzymeReaction/2536624
pathway order: PathwayInteraction/5104
pathway order: PathwayInteraction/3374
pathway order: PathwayTransport/2536627
pathway order: PathwayInteraction/5078
pathway order: PathwayTransport/2536847
pathway component: TransportCatalysis4823
pathway component: TransportCatalysis5932
pathway component: ReactionCatalysis207629
pathway component: Reaction219556
pathway component: Interaction5104
pathway component: Reaction218277
pathway component: Interaction3374
pathway component: Interaction5078
pathway component: Transport15986
pathway component: ReactionCatalysis208940
pathway component: Transport15985
pathway component: ReactionCatalysis207694
pathway component: Transport13773
pathway component: Reaction218331
pathway component: Transport14010
pathway component: Transport14012
pathway component: ReactionCatalysis80
pathway component: TransportCatalysis4991
pathway component: SubPathwayControl121425
pathway component: 4.1.1.28
pathway component: 4.6.1.1
pathway component: ReactionCatalysis214
xref: Reference/PathWhiz PW128313
xref: Reference/SMPDB SMP0126709
organism: Homo sapiens

Amine oxidase [flavin-containing] B
type: Protein
cellular location: Mitochondrial Outer Membrane
entity reference: Amine oxidase [flavin-containing] B

Reference/BioCyc L-DOPA
type: UnificationXref
id: L-DOPA
db: BioCyc

Reference/ChEBI CHEBI 28111
type: UnificationXref
id: CHEBI:28111
db: ChEBI

cAMP
type: SmallMoleculeReference
xref: Reference/PubChem-compound 6076
xref: Reference/HMDB HMDB0000058
xref: Reference/ChEBI CHEBI 17489
xref: Reference/CAS 60-92-4
xref: Reference/BioCyc CAMP
xref: Reference/ChemSpider 5851
xref: Reference/KEGG Compound C00575
chemical formula: C10H12N5O6P
molecular weight: 329.05252
structure: ChemicalStructure/PW C000041

S-Adenosylmethionine
type: SmallMoleculeReference
xref: Reference/PubChem-compound 24762165
xref: Reference/KEGG Compound C00019
xref: Reference/ChemSpider 31983
xref: Reference/ChEBI CHEBI 15414
xref: Reference/CAS 485-80-3
xref: Reference/BioCyc S-ADENOSYLMETHIONINE
xref: Reference/HMDB HMDB0001185
chemical formula: C15H23N6O5S
molecular weight: 399.14505
structure: ChemicalStructure/PW C000921

Reference/UniProt Q08462
type: UnificationXref
id: Q08462
db: UniProt

ReactionCatalysis207629
type: Catalysis
controller: Tyrosine 3-monooxygenase
controlled: Reaction218277
control type: ACTIVATION

Compound/PW C000921 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: S-Adenosylmethionine
stoichiometric coefficient: 1.0

Reference/ChemSpider 5742
type: UnificationXref
id: 5742
db: ChemSpider

Reference/KEGG Compound C05587
type: UnificationXref
id: C05587
db: KEGG Compound

Reference/UniProt P14416
type: UnificationXref
id: P14416
db: UniProt

Reference/PubChem-compound 6047
type: UnificationXref
id: 6047
db: PubChem-compound

Reference/KEGG Compound C00575
type: UnificationXref
id: C00575
db: KEGG Compound

Rasagiline
type: SmallMolecule
cellular location: Extracellular Space
entity reference: Rasagiline

Reference/ChemSpider 952
type: UnificationXref
id: 952
db: ChemSpider

Reference/GENE ONTOLOGY GO 0005829
type: UnificationXref
id: GO:0005829
db: GENE ONTOLOGY

Transport13773
type: Transport
participant stoichiometry: Compound/PW C000052 Exocytic Vesicle/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000052 Cytosol/Stoichiometry/1.0
right: Dopamine
spontaneous: false
left: Dopamine
name: Dopamine (→) Transport: Homo sapiens, Brain, Neuron, Cytosol to Homo sapiens, Brain, Neuron, Exocytic Vesicle
conversion direction: LEFT_TO_RIGHT

Reference/ChemSpider 274
type: UnificationXref
id: 274
db: ChemSpider

Reference/BioCyc TYR
type: UnificationXref
id: TYR
db: BioCyc

Rasagiline
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: Rasagiline

Synaptic vesicular amine transporter
type: Protein
entity reference: Synaptic vesicular amine transporter

Tetrahydrobiopterin
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00272
xref: Reference/HMDB HMDB0000027
xref: Reference/CAS 17528-72-2
xref: Reference/BioCyc TETRA-H-BIOPTERIN
xref: Reference/PubChem-compound 1125
xref: Reference/ChemSpider 1093
xref: Reference/ChEBI CHEBI 15372
chemical formula: C9H15N5O3
molecular weight: 241.1175
structure: ChemicalStructure/PW C000019

Compound/PW C000027 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Dihydrobiopterin
stoichiometric coefficient: 1.0

Reference/BioCyc ADENOSYL-HOMO-CYS
type: UnificationXref
id: ADENOSYL-HOMO-CYS
db: BioCyc

3-Methoxytyramine
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 742324
xref: Reference/PubChem-compound 1669
xref: Reference/CAS 554-52-9
xref: Reference/KEGG Compound C05587
xref: Reference/HMDB HMDB0000022
xref: Reference/ChemSpider 1606
chemical formula: C9H13NO2
molecular weight: 167.09464
structure: ChemicalStructure/PW C000015

Reference/CAS 485-80-3
type: UnificationXref
id: 485-80-3
db: CAS

Neuronal Excitability
type: Pathway
name: InhibitorySubPathway

Reference/ChEBI CHEBI 16240
type: UnificationXref
id: CHEBI:16240
db: ChEBI

Reference/ChemSpider 5851
type: UnificationXref
id: 5851
db: ChemSpider

Reference/PubChem-compound 252
type: UnificationXref
id: 252
db: PubChem-compound

Reference/BioCyc PPI
type: UnificationXref
id: PPI
db: BioCyc

Dopamine
type: SmallMolecule
cellular location: Cytosol
entity reference: Dopamine

Compound/PW C009727 Extracellular Space/Stoichiometry/1.0
type: Stoichiometry
physical entity: Rasagiline
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 15765
type: UnificationXref
id: CHEBI:15765
db: ChEBI

ChemicalStructure/PW C000921
type: ChemicalStructure
structure format: SMILES

Reference/CAS 979-92-0
type: UnificationXref
id: 979-92-0
db: CAS

Carbon dioxide
type: SmallMolecule
cellular location: Cytosol
entity reference: Carbon dioxide

Cytosol
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005829

Reference/BioCyc CPD-6641
type: UnificationXref
id: CPD-6641
db: BioCyc

Reference/KEGG Compound C00355
type: UnificationXref
id: C00355
db: KEGG Compound

Reference/PubChem-compound 681
type: UnificationXref
id: 681
db: PubChem-compound

Reference/ChemSpider 217
type: UnificationXref
id: 217
db: ChemSpider

S-Adenosylhomocysteine
type: SmallMoleculeReference
xref: Reference/PubChem-compound 25246222
xref: Reference/ChemSpider 388301
xref: Reference/BioCyc ADENOSYL-HOMO-CYS
xref: Reference/CAS 979-92-0
xref: Reference/KEGG Compound C00021
xref: Reference/ChEBI CHEBI 16680
xref: Reference/HMDB HMDB0000939
chemical formula: C14H20N6O5S
molecular weight: 384.12158
structure: ChemicalStructure/PW C000749

Compound/PW C001420 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 742324
type: UnificationXref
id: CHEBI:742324
db: ChEBI

ChemicalStructure/PW C000015
type: ChemicalStructure
structure format: SMILES
structure data: COC1=C(O)C=CC(CCN)=C1

Reference/CAS 124-38-9
type: UnificationXref
id: 124-38-9
db: CAS

Reference/ChemSpider 1606
type: UnificationXref
id: 1606
db: ChemSpider

Reference/KEGG Compound C00007
type: UnificationXref
id: C00007
db: KEGG Compound

Compound/PW C000052 Exocytic Vesicle/Stoichiometry/1.0
type: Stoichiometry
physical entity: Dopamine
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 15414
type: UnificationXref
id: CHEBI:15414
db: ChEBI

Reference/KEGG Compound C03758
type: UnificationXref
id: C03758
db: KEGG Compound

ChemicalStructure/PW C000019
type: ChemicalStructure
structure format: SMILES

Reference/KEGG Compound C00001
type: UnificationXref
id: C00001
db: KEGG Compound

Reference/ChEBI CHEBI 18361
type: UnificationXref
id: CHEBI:18361
db: ChEBI

D(2) dopamine receptor
type: ProteinReference
xref: Reference/UniProt P14416
organism: BiologicalState789

Reference/ChEBI CHEBI 18243
type: UnificationXref
id: CHEBI:18243
db: ChEBI

Reference/KEGG Compound C00002
type: UnificationXref
id: C00002
db: KEGG Compound

Reference/UniProt P20711
type: UnificationXref
id: P20711
db: UniProt

ReactionCatalysis207694
type: Catalysis
controller: Catechol O-methyltransferase
controlled: Reaction218331
control type: ACTIVATION

Reaction218331
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000015 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000749 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000052 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000921 Cytosol/Stoichiometry/1.0
right: S-Adenosylhomocysteine
right: 3-Methoxytyramine
spontaneous: false
left: Dopamine
left: S-Adenosylmethionine
name: Dopamine + S-Adenosylmethionine ↔ 3-Methoxytyramine + S-Adenosylhomocysteine
conversion direction: REVERSIBLE

Reference/CAS 7664-41-7
type: UnificationXref
id: 7664-41-7
db: CAS

Pyrophosphate
type: SmallMolecule
cellular location: post-synaptic membrane
entity reference: Pyrophosphate

Tetrahydrobiopterin
type: SmallMolecule
cellular location: Cytosol
entity reference: Tetrahydrobiopterin

Reference/KEGG Compound C00019
type: UnificationXref
id: C00019
db: KEGG Compound

Compound/PW C000035 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Ammonia
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 17489
type: UnificationXref
id: CHEBI:17489
db: ChEBI

Oxygen
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: Oxygen

Compound/PW C002411 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Homovanillin
stoichiometric coefficient: 1.0

Reference/BioCyc CAMP
type: UnificationXref
id: CAMP
db: BioCyc

Reference/CELL TYPE ONTOLOGY CL 0000540
type: UnificationXref
id: CL:0000540
db: CELL TYPE ONTOLOGY

Neuron
type: CellVocabulary
xref: Reference/CELL TYPE ONTOLOGY CL 0000540

Reference/KEGG Compound C00011
type: UnificationXref
id: C00011
db: KEGG Compound

ChemicalStructure/PW C001316
type: ChemicalStructure
structure format: SMILES
structure data: O=C=O

Reference/BioCyc S-ADENOSYLMETHIONINE
type: UnificationXref
id: S-ADENOSYLMETHIONINE
db: BioCyc

Sodium-dependent dopamine transporter
type: Protein
entity reference: Sodium-dependent dopamine transporter

Reference/PubChem-compound 222
type: UnificationXref
id: 222
db: PubChem-compound

Reference/KEGG Compound C00014
type: UnificationXref
id: C00014
db: KEGG Compound

Reference/KEGG Compound C00013
type: UnificationXref
id: C00013
db: KEGG Compound

Extracellular Space
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005615

ChemicalStructure/PW C002411
type: ChemicalStructure
structure format: SMILES
structure data: COC1=C(O)C=CC(CC=O)=C1

Pyrophosphate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 644102
xref: Reference/BioCyc PPI
xref: Reference/ChemSpider 559142
xref: Reference/ChEBI CHEBI 18361
xref: Reference/HMDB HMDB0000250
xref: Reference/CAS 14000-31-8
xref: Reference/KEGG Compound C00013
chemical formula: H4O7P2
molecular weight: 177.94322
structure: ChemicalStructure/PW C000170

ChemicalStructure/PW C009727
type: ChemicalStructure
structure format: SMILES
structure data: C#CCN[C@@H]1CCC2=CC=CC=C12

Reference/PubChem-compound 5957
type: UnificationXref
id: 5957
db: PubChem-compound

Reference/GENE ONTOLOGY GO 0005741
type: UnificationXref
id: GO:0005741
db: GENE ONTOLOGY

Dopamine
type: SmallMoleculeReference
xref: Reference/CAS 51-61-6
xref: Reference/KEGG Compound C03758
xref: Reference/ChemSpider 661
xref: Reference/BioCyc DOPAMINE
xref: Reference/HMDB HMDB0000073
xref: Reference/PubChem-compound 681
xref: Reference/ChEBI CHEBI 18243
chemical formula: C8H11NO2
molecular weight: 153.07898
structure: ChemicalStructure/PW C000052

TransportCatalysis4823
type: Catalysis
controller: Synaptic vesicular amine transporter
controlled: Transport13773
control type: ACTIVATION

Reference/ChemSpider 388301
type: UnificationXref
id: 388301
db: ChemSpider

Tyrosine 3-monooxygenase
type: Protein
cellular location: Cytosol
entity reference: Tyrosine 3-monooxygenase

Reaction219556
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420 Mitochondrial Outer Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000035 Mitochondrial Outer Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000015 Mitochondrial Outer Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Mitochondrial Outer Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C002411 Mitochondrial Outer Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001783 Mitochondrial Outer Membrane/Stoichiometry/1.0
right: Ammonia
right: Hydrogen peroxide
right: Homovanillin
spontaneous: false
left: 3-Methoxytyramine
left: Oxygen
left: Water
name: 3-Methoxytyramine + Oxygen + Water ↔ Ammonia + Homovanillin + Hydrogen peroxide
conversion direction: REVERSIBLE

ChemicalStructure/PW C000117
type: ChemicalStructure
structure format: SMILES
structure data: N[C@@H](CC1=CC=C(O)C(O)=C1)C(O)=O

Reference/KEGG Compound C00021
type: UnificationXref
id: C00021
db: KEGG Compound

Reference/CAS 56-65-5
type: UnificationXref
id: 56-65-5
db: CAS

Reference/KEGG Compound C00027
type: UnificationXref
id: C00027
db: KEGG Compound

post-synaptic membrane
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0045211

Reference/KEGG Compound C00272
type: UnificationXref
id: C00272
db: KEGG Compound

Transport14010
type: Transport
participant stoichiometry: Compound/PW C000052 Synapse/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000052 Cytosol/Stoichiometry/1.0
right: Dopamine
spontaneous: false
left: Dopamine
name: Dopamine (→) Transport: Homo sapiens, Brain, Neuron, Cytosol to Homo sapiens, Brain, Neuron, Synapse
conversion direction: LEFT_TO_RIGHT

Reference/GENE ONTOLOGY GO 0005615
type: UnificationXref
id: GO:0005615
db: GENE ONTOLOGY

Transport14012
type: Transport
participant stoichiometry: Compound/PW C000052 Exocytic Vesicle/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000052 Cytosol/Stoichiometry/1.0
right: Dopamine
spontaneous: false
left: Dopamine
name: Dopamine (→) Transport: Homo sapiens, Brain, Neuron, Exocytic Vesicle to Homo sapiens, Brain, Neuron, Cytosol
conversion direction: LEFT_TO_RIGHT

ReactionCatalysis80
type: Catalysis
controller: Adenylate cyclase type 2
controlled: 4.6.1.1
control type: ACTIVATION

Reference/CAS 60-92-4
type: UnificationXref
id: 60-92-4
db: CAS

Compound/PW C001783 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen peroxide
stoichiometric coefficient: 1.0

Reference/ChemSpider 133331
type: UnificationXref
id: 133331
db: ChemSpider

Mitochondrial Outer Membrane
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005741

Synaptic vesicular amine transporter
type: ProteinReference
xref: Reference/UniProt Q05940

Compound/PW C000052 Synapse/Stoichiometry/1.0
type: Stoichiometry
physical entity: Dopamine
stoichiometric coefficient: 1.0

Reference/ChemSpider 2314553
type: UnificationXref
id: 2314553
db: ChemSpider

Dopamine
type: SmallMolecule
cellular location: Exocytic Vesicle
entity reference: Dopamine

Reference/BRENDA TISSUE ONTOLOGY BTO 0000142
type: UnificationXref
id: BTO:0000142
db: BRENDA TISSUE ONTOLOGY

ChemicalStructure/PW C000052
type: ChemicalStructure
structure format: SMILES
structure data: NCCC1=CC(O)=C(O)C=C1

Reference/BioCyc TETRA-H-BIOPTERIN
type: UnificationXref
id: TETRA-H-BIOPTERIN
db: BioCyc

Reference/BioCyc HYDROGEN-PEROXIDE
type: UnificationXref
id: HYDROGEN-PEROXIDE
db: BioCyc

Reference/PubChem-compound 3052776
type: UnificationXref
id: 3052776
db: PubChem-compound

Reference/BioCyc BIOPTERIN
type: UnificationXref
id: BIOPTERIN
db: BioCyc

4.6.1.1
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000041 post-synaptic membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000170 post-synaptic membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000414 post-synaptic membrane/Stoichiometry/1.0
right: cAMP
right: Pyrophosphate
spontaneous: false
EC number: 4.6.1.1
left: Adenosine triphosphate
name: Adenosine triphosphate → Pyrophosphate + cAMP
conversion direction: LEFT_TO_RIGHT

Reference/HMDB HMDB0000250
type: UnificationXref
id: HMDB0000250
db: HMDB

ChemicalStructure/PW C000170
type: ChemicalStructure
structure format: SMILES
structure data: OP(O)(=O)OP(O)(O)=O

Reference/CAS 14000-31-8
type: UnificationXref
id: 14000-31-8
db: CAS

Water
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: Water

Dopamine
type: SmallMolecule
cellular location: post-synaptic membrane
entity reference: Dopamine

Reference/UniProt Q05940
type: UnificationXref
id: Q05940
db: UniProt

Interaction5078
type: MolecularInteraction
interaction type: direct_interaction
name: D(2) dopamine receptor inhibits Adenylate cyclase type 2
participant: D(2) dopamine receptor
participant: Adenylate cyclase type 2

S-Adenosylmethionine
type: SmallMolecule
cellular location: Cytosol
entity reference: S-Adenosylmethionine

Reference/HMDB HMDB0000939
type: UnificationXref
id: HMDB0000939
db: HMDB

Reference/GENE ONTOLOGY GO 0045211
type: UnificationXref
id: GO:0045211
db: GENE ONTOLOGY

Reference/ChemSpider 763
type: UnificationXref
id: 763
db: ChemSpider

Compound/PW C009727 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Rasagiline
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0000027
type: UnificationXref
id: HMDB0000027
db: HMDB

Reference/CAS 59-92-7
type: UnificationXref
id: 59-92-7
db: CAS

Reference/HMDB HMDB0000022
type: UnificationXref
id: HMDB0000022
db: HMDB

Reference/PubChem-compound 784
type: UnificationXref
id: 784
db: PubChem-compound

Reference/ChEBI CHEBI 15422
type: UnificationXref
id: CHEBI:15422
db: ChEBI

Reference/CAS 51-61-6
type: UnificationXref
id: 51-61-6
db: CAS

Homo sapiens
type: BioSource
xref: Reference/TAXONOMY 9606

ChemicalStructure/PW C000027
type: ChemicalStructure
structure format: SMILES

Reference/CAS 7732-18-5
type: UnificationXref
id: 7732-18-5
db: CAS

Reference/HMDB HMDB0000158
type: UnificationXref
id: HMDB0000158
db: HMDB

Oxygen
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001377
xref: Reference/ChemSpider 952
xref: Reference/KEGG Compound C00007
xref: Reference/ChEBI CHEBI 15379
xref: Reference/PubChem-compound 977
xref: Reference/BioCyc CPD-6641
xref: Reference/CAS 7782-44-7
chemical formula: O2
molecular weight: 31.98983
structure: ChemicalStructure/PW C001065

Reference/HMDB HMDB0000038
type: UnificationXref
id: HMDB0000038
db: HMDB

Exocytic Vesicle
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0070382

Reference/BioCyc AMMONIA
type: UnificationXref
id: AMMONIA
db: BioCyc

ChemicalStructure/PW C000035
type: ChemicalStructure
structure format: SMILES
structure data: N

SubPathwayControl121425
type: Interaction
name: SubPathway121425Control
name: InhibitorySubPathwayControl
participant: cAMP
participant: Neuronal Excitability

Dihydrobiopterin
type: SmallMolecule
cellular location: Cytosol
entity reference: Dihydrobiopterin

Reference/UniProt P27338
type: UnificationXref
id: P27338
db: UniProt

Hydrogen peroxide
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: Hydrogen peroxide

Water
type: SmallMolecule
cellular location: Cytosol
entity reference: Water

Reference/PubChem-compound 151276
type: UnificationXref
id: 151276
db: PubChem-compound

Reference/CAS 60-18-4
type: UnificationXref
id: 60-18-4
db: CAS

3-Methoxytyramine
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: 3-Methoxytyramine

Adenosine triphosphate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15422
xref: Reference/PubChem-compound 5957
xref: Reference/HMDB HMDB0000538
xref: Reference/CAS 56-65-5
xref: Reference/ChemSpider 5742
xref: Reference/BioCyc ATP
xref: Reference/KEGG Compound C00002
chemical formula: C10H16N5O13P3
molecular weight: 506.99576
structure: ChemicalStructure/PW C000414

Sodium-dependent dopamine transporter
type: ProteinReference
xref: Reference/UniProt Q01959

Reference/BioCyc DOPAMINE
type: UnificationXref
id: DOPAMINE
db: BioCyc

Reference/ChEBI CHEBI 16526
type: UnificationXref
id: CHEBI:16526
db: ChEBI

Reference/ChemSpider 1093
type: UnificationXref
id: 1093
db: ChemSpider

Dopamine
type: SmallMolecule
cellular location: Synapse
entity reference: Dopamine

Reference/CAS 7782-44-7
type: UnificationXref
id: 7782-44-7
db: CAS

Reference/HMDB HMDB0001377
type: UnificationXref
id: HMDB0001377
db: HMDB

S-Adenosylhomocysteine
type: SmallMolecule
cellular location: Cytosol
entity reference: S-Adenosylhomocysteine

ChemicalStructure/PW C000041
type: ChemicalStructure
structure format: SMILES

Reference/ChemSpider 661
type: UnificationXref
id: 661
db: ChemSpider

Compound/PW C000414 post-synaptic membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine triphosphate
stoichiometric coefficient: 1.0

Adenosine triphosphate
type: SmallMolecule
cellular location: post-synaptic membrane
entity reference: Adenosine triphosphate

Reference/PubChem-compound 1669
type: UnificationXref
id: 1669
db: PubChem-compound

Reference/HMDB HMDB0005175
type: UnificationXref
id: HMDB0005175
db: HMDB

Compound/PW C001420 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Reference/CAS 136236-51-6
type: UnificationXref
id: 136236-51-6
db: CAS

Reference/TAXONOMY 9606
type: UnificationXref
id: 9606
db: TAXONOMY

Reference/PubChem-compound 962
type: UnificationXref
id: 962
db: PubChem-compound

Reference/ChemSpider 31983
type: UnificationXref
id: 31983
db: ChemSpider

Reference/CAS 5703-24-2
type: UnificationXref
id: 5703-24-2
db: CAS

Reference/UniProt P07101
type: UnificationXref
id: P07101
db: UniProt

Reference/CAS 17528-72-2
type: UnificationXref
id: 17528-72-2
db: CAS

L-Tyrosine
type: SmallMoleculeReference
xref: Reference/CAS 60-18-4
xref: Reference/PubChem-compound 6057
xref: Reference/HMDB HMDB0000158
xref: Reference/ChEBI CHEBI 17895
xref: Reference/KEGG Compound C00082
xref: Reference/ChemSpider 5833
xref: Reference/BioCyc TYR
chemical formula: C9H11NO3
molecular weight: 181.0739
structure: ChemicalStructure/PW C000103

3-Methoxytyramine
type: SmallMolecule
cellular location: Cytosol
entity reference: 3-Methoxytyramine

Reaction218277
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000103 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000117 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000027 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000019 Cytosol/Stoichiometry/1.0
right: L-Dopa
right: Dihydrobiopterin
right: Water
spontaneous: false
left: Oxygen
left: L-Tyrosine
left: Tetrahydrobiopterin
name: L-Tyrosine + Oxygen + Tetrahydrobiopterin ↔ Dihydrobiopterin + L-Dopa + Water
conversion direction: REVERSIBLE

Carbon dioxide
type: SmallMoleculeReference
xref: Reference/PubChem-compound 280
xref: Reference/ChEBI CHEBI 16526
xref: Reference/ChemSpider 274
xref: Reference/HMDB HMDB0001967
xref: Reference/CAS 124-38-9
xref: Reference/KEGG Compound C00011
chemical formula: CO2
molecular weight: 43.98983
structure: ChemicalStructure/PW C001316

Adenylate cyclase type 2
type: ProteinReference
xref: Reference/UniProt Q08462
organism: BiologicalState789

Adenylate cyclase type 2
type: Protein
cellular location: post-synaptic membrane
entity reference: Adenylate cyclase type 2

D(2) dopamine receptor
type: Protein
cellular location: post-synaptic membrane
entity reference: D(2) dopamine receptor

Compound/PW C009727/Stoichiometry/1.0
type: Stoichiometry
physical entity: Rasagiline
stoichiometric coefficient: 1.0

ChemicalStructure/PW C001065
type: ChemicalStructure
structure format: SMILES
structure data: O=O

Reference/HMDB HMDB0000058
type: UnificationXref
id: HMDB0000058
db: HMDB

Rasagiline
type: SmallMoleculeReference
xref: Reference/PubChem-compound 3052776
xref: Reference/ChemSpider 2314553
xref: Reference/CAS 136236-51-6
xref: Reference/ChEBI CHEBI 63620
xref: Reference/HMDB HMDB0015454
chemical formula: C12H13N
molecular weight: 171.1048
structure: ChemicalStructure/PW C009727

Compound/PW C000170 post-synaptic membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Pyrophosphate
stoichiometric coefficient: 1.0

cAMP
type: SmallMolecule
cellular location: post-synaptic membrane
entity reference: cAMP
name: SubPathwayInhibitor

Homovanillin
type: SmallMoleculeReference
xref: Reference/PubChem-compound 151276
xref: Reference/CAS 5703-24-2
xref: Reference/KEGG Compound C05581
xref: Reference/HMDB HMDB0005175
xref: Reference/ChEBI CHEBI 28111
xref: Reference/ChemSpider 133331
chemical formula: C9H10O3
molecular weight: 166.06299
structure: ChemicalStructure/PW C002411

Reference/KEGG Compound C00082
type: UnificationXref
id: C00082
db: KEGG Compound

TransportCatalysis4991
type: Catalysis
controller: Sodium-dependent dopamine transporter
controlled: Transport14010
control type: ACTIVATION

Reference/HMDB HMDB0000051
type: UnificationXref
id: HMDB0000051
db: HMDB

Reference/HMDB HMDB0002111
type: UnificationXref
id: HMDB0002111
db: HMDB

Reference/ChEBI CHEBI 15377
type: UnificationXref
id: CHEBI:15377
db: ChEBI

Reference/PubChem-compound 6057
type: UnificationXref
id: 6057
db: PubChem-compound

Reference/ChEBI CHEBI 15379
type: UnificationXref
id: CHEBI:15379
db: ChEBI

L-Dopa
type: SmallMoleculeReference
xref: Reference/ChemSpider 5824
xref: Reference/CAS 59-92-7
xref: Reference/ChEBI CHEBI 15765
xref: Reference/HMDB HMDB0000181
xref: Reference/BioCyc L-DOPA
xref: Reference/KEGG Compound C00355
xref: Reference/PubChem-compound 6047
chemical formula: C9H11NO4
molecular weight: 197.0688
structure: ChemicalStructure/PW C000117

ChemicalStructure/PW C000414
type: ChemicalStructure
structure format: SMILES

Catechol O-methyltransferase
type: Protein
cellular location: Cytosol
entity reference: Catechol O-methyltransferase

Reference/ChEBI CHEBI 15372
type: UnificationXref
id: CHEBI:15372
db: ChEBI

Interaction3374
type: MolecularInteraction
interaction type: direct_interaction
name: Dopamine activates D(2) dopamine receptor
participant: D(2) dopamine receptor
participant: Dopamine

Homovanillin
type: SmallMolecule
cellular location: Mitochondrial Outer Membrane
entity reference: Homovanillin

ReactionCatalysis208940
type: Catalysis
controller: Amine oxidase [flavin-containing] B
controlled: Reaction219556
control type: ACTIVATION

Oxygen
type: SmallMolecule
cellular location: Cytosol
entity reference: Oxygen

Compound/PW C000015 Mitochondrial Outer Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: 3-Methoxytyramine
stoichiometric coefficient: 1.0

Reference/PubChem-compound 280
type: UnificationXref
id: 280
db: PubChem-compound

Reference/HMDB HMDB0000181
type: UnificationXref
id: HMDB0000181
db: HMDB

ReactionCatalysis214
type: Catalysis
controller: Aromatic-L-amino-acid decarboxylase
controlled: 4.1.1.28
control type: ACTIVATION

Reference/ChemSpider 5824
type: UnificationXref
id: 5824
db: ChemSpider

Reference/ChEBI CHEBI 64277
type: UnificationXref
id: CHEBI:64277
db: ChEBI

Compound/PW C000117 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Dopa
stoichiometric coefficient: 1.0

Reference/PubChem-compound 644102
type: UnificationXref
id: 644102
db: PubChem-compound

Interaction5104
type: MolecularInteraction
interaction type: direct_interaction
name: Rasagiline inhibits Amine oxidase [flavin-containing] B
participant: Amine oxidase [flavin-containing] B
participant: Rasagiline

Reference/KEGG Compound C02953
type: UnificationXref
id: C02953
db: KEGG Compound

ChemicalStructure/PW C000749
type: ChemicalStructure
structure format: SMILES

Reference/CAS 6779-87-9
type: UnificationXref
id: 6779-87-9
db: CAS

Rasagiline
type: SmallMolecule
entity reference: Rasagiline

Compound/PW C000015 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: 3-Methoxytyramine
stoichiometric coefficient: 1.0

Reference/PubChem-compound 25246222
type: UnificationXref
id: 25246222
db: PubChem-compound

L-Dopa
type: SmallMolecule
cellular location: Cytosol
entity reference: L-Dopa

Compound/PW C000041 post-synaptic membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: cAMP
stoichiometric coefficient: 1.0

Water
type: SmallMoleculeReference
xref: Reference/PubChem-compound 962
xref: Reference/ChEBI CHEBI 15377
xref: Reference/KEGG Compound C00001
xref: Reference/ChemSpider 937
xref: Reference/HMDB HMDB0002111
xref: Reference/CAS 7732-18-5
chemical formula: H2O
molecular weight: 18.010565
structure: ChemicalStructure/PW C001420

Hydrogen peroxide
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0003125
xref: Reference/PubChem-compound 784
xref: Reference/ChemSpider 763
xref: Reference/CAS 7722-84-1
xref: Reference/BioCyc HYDROGEN-PEROXIDE
xref: Reference/ChEBI CHEBI 16240
xref: Reference/KEGG Compound C00027
chemical formula: H2O2
molecular weight: 34.005478
structure: ChemicalStructure/PW C001783

Reference/HMDB HMDB0000073
type: UnificationXref
id: HMDB0000073
db: HMDB

Reference/SMPDB SMP0126709
type: UnificationXref
id: SMP0126709
db: SMPDB

Reference/GENE ONTOLOGY GO 0045202
type: UnificationXref
id: GO:0045202
db: GENE ONTOLOGY

Reference/ChEBI CHEBI 17895
type: UnificationXref
id: CHEBI:17895
db: ChEBI

Reference/PubChem-compound 6076
type: UnificationXref
id: 6076
db: PubChem-compound

Reference/PubChem-compound 977
type: UnificationXref
id: 977
db: PubChem-compound

Reference/PathWhiz PW128313
type: UnificationXref
id: PW128313
db: PathWhiz

Compound/PW C001316 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Carbon dioxide
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0001967
type: UnificationXref
id: HMDB0001967
db: HMDB

Reference/ChEBI CHEBI 16680
type: UnificationXref
id: CHEBI:16680
db: ChEBI

Compound/PW C009727 Synapse/Stoichiometry/1.0
type: Stoichiometry
physical entity: Rasagiline
stoichiometric coefficient: 1.0

Transport15986
type: Transport
participant stoichiometry: Compound/PW C009727 Mitochondrial Outer Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C009727 Synapse/Stoichiometry/1.0
right: Rasagiline
spontaneous: false
left: Rasagiline
name: Rasagiline (→) Transport: Homo sapiens, Brain, Neuron, Synapse to Homo sapiens, Brain, Neuron, Mitochondrial Outer Membrane
conversion direction: LEFT_TO_RIGHT

Reference/HMDB HMDB0015454
type: UnificationXref
id: HMDB0015454
db: HMDB

Reference/PubChem-compound 24762165
type: UnificationXref
id: 24762165
db: PubChem-compound

Transport15985
type: Transport
participant stoichiometry: Compound/PW C009727 Extracellular Space/Stoichiometry/1.0
participant stoichiometry: Compound/PW C009727/Stoichiometry/1.0
right: Rasagiline
spontaneous: true
left: Rasagiline
name: Rasagiline (→) Transport: Homo sapiens, Blood Vessel to Homo sapiens, Brain, Extracellular Space
conversion direction: REVERSIBLE

4.1.1.28
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000117 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001316 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000052 Cytosol/Stoichiometry/1.0
right: Carbon dioxide
right: Dopamine
spontaneous: false
EC number: 4.1.1.28
left: L-Dopa
name: L-Dopa → Carbon dioxide + Dopamine
conversion direction: LEFT_TO_RIGHT

Reference/ChEBI CHEBI 63620
type: UnificationXref
id: CHEBI:63620
db: ChEBI

Aromatic-L-amino-acid decarboxylase
type: Protein
cellular location: Cytosol
entity reference: Aromatic-L-amino-acid decarboxylase

Synapse
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0045202