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BDBM50305439 2-(1-(2-chlorophenyl)-5-(4-chlorophenyl)-3-(5-fluoroisoindoline-2-carbonyl)-1H-pyrazol-4-yl)acetonitrile::CHEMBL592767

SMILES: Fc1ccc2CN(Cc2c1)C(=O)c1nn(c(c1CC#N)-c1ccc(Cl)cc1)-c1ccccc1Cl

InChI Key: InChIKey=DURFBHYFPDMOCA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50305439   
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))
BDBM50305439
PNG
(2-(1-(2-chlorophenyl)-5-(4-chlorophenyl)-3-(5-fluo...)
Show SMILES Fc1ccc2CN(Cc2c1)C(=O)c1nn(c(c1CC#N)-c1ccc(Cl)cc1)-c1ccccc1Cl
Show InChI InChI=1S/C26H17Cl2FN4O/c27-19-8-5-16(6-9-19)25-21(11-12-30)24(31-33(25)23-4-2-1-3-22(23)28)26(34)32-14-17-7-10-20(29)13-18(17)15-32/h1-10,13H,11,14-15H2
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.70n/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