BDBM50204193 6-(2-chlorophenyl)-5-(4-chlorophenyl)-2-(4-pivaloylpiperazin-1-yl)nicotinonitrile::CHEMBL246686

SMILES: CC(C)(C)C(=O)N1CCN(CC1)c1nc(-c2ccccc2Cl)c(cc1C#N)-c1ccc(Cl)cc1

InChI Key: InChIKey=HBQAIROLYJEHCY-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50204193   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50204193 (6-(2-chlorophenyl)-5-(4-chlorophenyl)-2-(4-pivaloy...) Show SMILES CC(C)(C)C(=O)N1CCN(CC1)c1nc(-c2ccccc2Cl)c(cc1C#N)-c1ccc(Cl)cc1 Show InChI InChI=1S/C27H26Cl2N4O/c1-27(2,3)26(34)33-14-12-32(13-15-33)25-19(17-30)16-22(18-8-10-20(28)11-9-18)24(31-25)21-6-4-5-7-23(21)29/h4-11,16H,12-15H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity at CB1 receptor				Bioorg Med Chem Lett 17: 2031-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.005 BindingDB Entry DOI: 10.7270/Q27944BJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50204193 (6-(2-chlorophenyl)-5-(4-chlorophenyl)-2-(4-pivaloy...) Show SMILES CC(C)(C)C(=O)N1CCN(CC1)c1nc(-c2ccccc2Cl)c(cc1C#N)-c1ccc(Cl)cc1 Show InChI InChI=1S/C27H26Cl2N4O/c1-27(2,3)26(34)33-14-12-32(13-15-33)25-19(17-30)16-22(18-8-10-20(28)11-9-18)24(31-25)21-6-4-5-7-23(21)29/h4-11,16H,12-15H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity at CB2 receptor				Bioorg Med Chem Lett 17: 2031-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.005 BindingDB Entry DOI: 10.7270/Q27944BJ
					More data for this Ligand-Target Pair