Drug General Information
Drug ID
DX1PK8
Drug Name
N-(((cis)-4-(4-(dimethylamino)-5-methylpyrimidin-2-ylamino)cyclohexyl)methyl)-3,4-difluorobenzamide
Synonyms
CHEMBL577904
Indication Discovery agent Investigative [1587926]
Formula
C21H27F2N5O
Canonical SMILES
CN(C)c1nc(N[C@@H]2CC[C@H](CNC(=O)c3ccc(F)c(F)c3)CC2)ncc1C
InChI
InChI=1S/C21H27F2N5O/c1-13-11-25-21(27-19(13)28(2)3)26-16-7-4-14(5-8-16)12-24-20(29)15-6-9-17(22)18(23)10-15/h6,9-11,14,16H,4-5,7-8,12H2,1-3H3,(H,24,29)(H,25,26,27)/t14-,16+
InChIKey
NFQWOMAFZMZYOX-FZNQNYSPSA-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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