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BDBM50310033 4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-bromophenyl)-N-tert-butyl-1-(2-chlorophenyl)-1H-pyrazole-3-carboxamide::CHEMBL596697

SMILES: CC(C)(C)NC(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Br)cc1)-c1ccccc1Cl

InChI Key: InChIKey=VYKSHBBSSQRPPN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50310033   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50310033
PNG
(4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-bromophenyl...)
Show SMILES CC(C)(C)NC(=O)c1nn(c(c1Cn1cncn1)-c1ccc(Br)cc1)-c1ccccc1Cl
Show InChI InChI=1S/C23H22BrClN6O/c1-23(2,3)28-22(32)20-17(12-30-14-26-13-27-30)21(15-8-10-16(24)11-9-15)31(29-20)19-7-5-4-6-18(19)25/h4-11,13-14H,12H2,1-3H3,(H,28,32)
PDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.90n/an/an/an/an/an/a



Green Cross Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from CB1 receptor in Sprague-Dawley rat cerebellar membrane


Bioorg Med Chem 18: 1149-62 (2010)


Article DOI: 10.1016/j.bmc.2009.12.040
BindingDB Entry DOI: 10.7270/Q2TD9XG2
More data for this
Ligand-Target Pair