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BDBM50305425 CHEMBL589885::N-((1R,2R,4S)-bicyclo[2.2.1]heptan-2-yl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)-4-(cyanomethyl)-1H-pyrazole-3-carboxamide

SMILES: Clc1ccc(cc1)-c1c(CC#N)c(nn1-c1ccccc1Cl)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1C2

InChI Key: InChIKey=PMJATBMXBOJZTA-LUQKVYGDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50305425   
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


(Homo sapiens (Human))
BDBM50305425
PNG
(CHEMBL589885 | N-((1R,2R,4S)-bicyclo[2.2.1]heptan-...)
Show SMILES Clc1ccc(cc1)-c1c(CC#N)c(nn1-c1ccccc1Cl)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1C2 |r,TLB:24:25:29.28:31|
Show InChI InChI=1S/C25H22Cl2N4O/c26-18-9-7-16(8-10-18)24-19(11-12-28)23(30-31(24)22-4-2-1-3-20(22)27)25(32)29-21-14-15-5-6-17(21)13-15/h1-4,7-10,15,17,21H,5-6,11,13-14H2,(H,29,32)/t15-,17+,21+/m0/s1
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.20n/an/an/an/an/an/a



7TM Pharma A/S

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant CB1 receptor expressed in CHO-K1 cells assessed as inhibition of CP55940-stimulated GTPgammaS binding


Bioorg Med Chem Lett 20: 26-30 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.047
BindingDB Entry DOI: 10.7270/Q28G8KS9
More data for this
Ligand-Target Pair