DrugCentral 2023 🐕
2022 Update-Veterinary Drugs & Uses
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Structure 🔎
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L1000
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DrugCentral 2023 🐕
2022 Update-Veterinary Drugs & Uses
Search
Structure 🔎
Similarity 🔎
Smart API
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L1000
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FDA-approved
EMA-approved
PMDA-approved
Target Card Uniprot Example:
P23975
nemonapride 🐶
Veterinary Use |
Indications/Contra
| FAERs-F
| FAERs-M
| Orange Bk
| BioActivity |
Stem definition
Drug id
CAS RN
sulpiride derivatives and analogues
1895
75272-39-8
Description:
Molecule
Description
Molfile
Inchi
Smiles
Synonyms:
nemonapride
emonapride
an atypical antipsychotic approved in Japan for the treatment of schizophrenia
Molecular weight: 387.91
Formula: C21H26ClN3O2
CLOGP: 4.31
LIPINSKI: 0
HAC: 5
HDO: 2
TPSA: 53.60
ALOGS: -4.51
ROTB: 6
Drug dosage:
None
ADMET properties:
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Property
Value
Reference
BDDCS (Biopharmaceutical Drug Disposition Classification System)
2
Hosey CM, Chan R, Benet LZ
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Approvals:
None
FDA Adverse Event Reporting System (Female)
None
FDA Adverse Event Reporting System (Male)
None
FDA Adverse Event Reporting System (Geriatric)
None
FDA Adverse Event Reporting System (Pediatric)
None
Pharmacologic Action:
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Source
Code
Description
CHEBI has role
CHEBI:35941
serotonin agonists
CHEBI has role
CHEBI:48561
dopaminergic antagonists
CHEBI has role
CHEBI:65191
atypical antipsychotic agent
MeSH PA
D014150
Antipsychotic Agents
MeSH PA
D002491
Central Nervous System Agents
MeSH PA
D002492
Central Nervous System Depressants
MeSH PA
D015259
Dopamine Agents
MeSH PA
D018492
Dopamine Antagonists
MeSH PA
D018377
Neurotransmitter Agents
MeSH PA
D011619
Psychotropic Drugs
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Drug Use
| Suggest Off label Use Form|
|View source of the data|
None
🐶 Veterinary Drug Use
None
🐶 Veterinary products
None
Acid dissociation constants calculated using MoKa v3.0.0
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Dissociation level
Dissociation constant
Type (acidic/basic)
pKa1
9.07
acidic
pKa2
7.63
Basic
pKa3
3.08
Basic
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Orange Book patent data (new drug applications)
None
Orange Book exclusivity data (new drug applications)
None
Bioactivity Summary:
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Target
Class
Pharos
UniProt
Action
Type
Activity value
(-log[M])
Mechanism
action
Bioact source
MoA source
D(2) dopamine receptor
GPCR
P14416
DRD2_HUMAN
Ki
8.58
CHEMBL
D(3) dopamine receptor
GPCR
P35462
DRD3_HUMAN
ANTAGONIST
Ki
9.30
IUPHAR
D(4) dopamine receptor
GPCR
P21917
DRD4_HUMAN
Kd
9.68
CHEMBL
Transmembrane protein 97
Enzyme
Q5BJF2
TMM97_HUMAN
Ki
8.14
CHEMBL
Alpha-1A adrenergic receptor
GPCR
ADA1A_RAT
IC50
6.27
CHEMBL
D(2) dopamine receptor
GPCR
DRD2_RAT
Ki
9.80
CHEMBL
5-hydroxytryptamine receptor 2A
GPCR
5HT2A_RAT
IC50
7.31
CHEMBL
D(3) dopamine receptor
GPCR
DRD3_RAT
Ki
9.80
CHEMBL
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External reference:
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ID
Source
AQD
PDB_CHEM_ID
156333
PUBCHEM_CID
6430
INN_ID
983
IUPHAR_LIGAND_ID
C0217937
UMLSCUI
C030265
MESH_SUPPLEMENTAL_RECORD_UI
CHEBI:31899
CHEBI
CHEMBL20734
ChEMBL_ID
CHEMBL274491
ChEMBL_ID
D01468
KEGG_DRUG
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Pharmaceutical products:
None
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nemonapride