Drug Information

Drug General Information
Drug ID
D0S2BB
Former ID
DNC001655
Drug Name
B173
Drug Type
Small molecular drug
Indication Discovery agent Investigative [551688]
Structure
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2D MOL

3D MOL
Formula
C18H22N2O5
Canonical SMILES
CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)O.C(=CC(=O)O)C(=O)O
InChI
1S/C14H18N2O.C4H4O4/c1-16-6-4-10(5-7-16)13-9-15-14-3-2-11(17)8-12(13)14;5-3(6)1-2-4(7)8/h2-3,8-10,15,17H,4-7H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey
INGCLXPSKXSYND-BTJKTKAUSA-N
PubChem Compound ID
11957480
PubChem Substance ID
17404770, 23919007, 24278120, 36454752, 50105949, 52787964, 53777313, 91703201, 92303544, 121360999, 123100641, 162227978, 163564161, 175612309, 230692706
Target and Pathway
Target(s) 5-hydroxytryptamine 1E receptor Target Info Agonist [551688]
KEGG Pathway cAMP signaling pathway
Neuroactive ligand-receptor interaction
Serotonergic synapse
PANTHER Pathway Heterotrimeric G-protein signaling pathway-Gi alpha and Gs alpha mediated pathway
5HT1 type receptor mediated signaling pathway
Reactome Serotonin receptors
G alpha (i) signalling events
WikiPathways Serotonin HTR1 Group and FOS Pathway
Monoamine GPCRs
GPCRs, Class A Rhodopsin-like
GPCR ligand binding
GPCR downstream signaling
References
Ref 551688The gamma-aminobutyric acid-B receptor agonist baclofen attenuates responding for ethanol in ethanol-dependent rats. Alcohol Clin Exp Res. 2007 Jan;31(1):11-8.
Ref 551688The gamma-aminobutyric acid-B receptor agonist baclofen attenuates responding for ethanol in ethanol-dependent rats. Alcohol Clin Exp Res. 2007 Jan;31(1):11-8.

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