Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50420889'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50420889 (CHEMBL2087098) Show SMILES O=C(Cc1cn(Cc2ccccc2)c2ccc(cc12)-c1ccccc1)NC12CC3CC(CC(C3)C1)C2 |TLB:25:26:29:33.32.31,THB:27:28:31:35.26.34,27:26:29.28.33:31,34:26:29:33.32.31,34:32:29:35.27.26| Show InChI InChI=1S/C33H34N2O/c36-32(34-33-18-24-13-25(19-33)15-26(14-24)20-33)17-29-22-35(21-23-7-3-1-4-8-23)31-12-11-28(16-30(29)31)27-9-5-2-6-10-27/h1-12,16,22,24-26H,13-15,17-21H2,(H,34,36)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]CP-55,940 from human recombinant CB1 receptor transfected in HEK cells				J Med Chem 55: 5391-402 (2012) Article DOI: 10.1021/jm3003334 BindingDB Entry DOI: 10.7270/Q2K64KCF
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