Drug General Information
Drug ID
DX5KKY
Drug Name
N-hydroxycarbamate derivative
Synonyms
CHEMBL181085
Indication Discovery agent Investigative [1587926]
Formula
C36H43F2N3O4
Canonical SMILES
CC(C)COC(=O)N(O)CCC#Cc1ccc(OCCCCN2CCN(CC2)C(c3ccc(F)cc3)c4ccc(F)cc4)cc1
InChI
InChI=1S/C36H43F2N3O4/c1-28(2)27-45-36(42)41(43)21-4-3-7-29-8-18-34(19-9-29)44-26-6-5-20-39-22-24-40(25-23-39)35(30-10-14-32(37)15-11-30)31-12-16-33(38)17-13-31/h8-19,28,35,43H,4-6,20-27H2,1-2H3
InChIKey
OHBPVXVMMZZMKM-UHFFFAOYSA-N
Target and Pathway
Target(s) Arachidonate 5-lipoxygenase Target Info [1587926]
Histamine H1 receptor Target Info [1587926]
BioCyc Pathway Aspirin-triggered lipoxin biosynthesis
Resolvin D biosynthesis
Leukotriene biosynthesis
Lipoxin biosynthesis
Aspirin triggered resolvin D biosynthesis
Aspirin triggered resolvin E biosynthesis
KEGG Pathway Arachidonic acid metabolism
Metabolic pathways
Serotonergic synapse
Ovarian steroidogenesis
Toxoplasmosishsa04020:Calcium signaling pathway
Neuroactive ligand-receptor interaction
Inflammatory mediator regulation of TRP channels
NetPath Pathway IL4 Signaling Pathway
PANTHER Pathway Histamine H1 receptor mediated signaling pathway
PathWhiz Pathway Arachidonic Acid Metabolism
Reactome Histamine receptors
G alpha (q) signalling events
WikiPathways Vitamin D Receptor Pathway
Arachidonic acid metabolism
Eicosanoid Synthesis
Selenium Micronutrient NetworkWP58: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

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.