Drug Information

Drug General Information
Drug ID
DXD1AW
Drug Name
4-[(4-Chlorophenyl)methyl]-2-(1-methylhexahydro-1H-azepin-3-yl)-1(2H)-phthalazinone
Synonyms
CHEMBL1767158
Indication Discovery agent Investigative [1587926]
Formula
C22H24ClN3O
Canonical SMILES
CN1CCCCC(C1)N2N=C(Cc3ccc(Cl)cc3)c4ccccc4C2=O
InChI
InChI=1S/C22H24ClN3O/c1-25-13-5-4-6-18(15-25)26-22(27)20-8-3-2-7-19(20)21(24-26)14-16-9-11-17(23)12-10-16/h2-3,7-12,18H,4-6,13-15H2,1H3
InChIKey
OEYDBWKMXFZENQ-UHFFFAOYSA-N
Target and Pathway
Target(s) Alpha-1 adrenergic receptor Target Info [1587926]
Histamine H1 receptor Target Info [1587926]
KEGG Pathway Calcium signaling pathway
Neuroactive ligand-receptor interaction
Inflammatory mediator regulation of TRP channels
PANTHER Pathway Histamine H1 receptor mediated signaling pathway
Reactome Histamine receptors
G alpha (q) signalling events
WikiPathways Monoamine GPCRs
GPCRs, Class A Rhodopsin-like
IL-4 Signaling Pathway
Gastrin-CREB signalling pathway via PKC and MAPK
GPCR ligand binding
GPCR downstream signaling
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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