Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50156028'   

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))	BDBM50156028 (CHEMBL3781544) Show SMILES CN(C)CCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c(=O)c2ccc(F)cc12 |TLB:18:17:20:14.13.12,18:13:20:17.19.16,THB:16:17:14.15.20:12,16:15:12:17.19.18| Show InChI InChI=1S/C33H39NO12S/c1-15(35)40-14-24-28(42-17(3)37)29(43-18(4)38)30(44-19(5)39)32(45-24)47-25-10-8-21-22-13-20-7-9-23(41-16(2)36)27-26(20)33(21,31(25)46-27)11-12-34(22)6/h7-10,21-22,24-25,28-32H,11-14H2,1-6H3/t21-,22+,24?,25?,28?,29?,30?,31-,32?,33-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	501	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-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins by Competition binding assay				J Med Chem 59: 1052-67 (2016) Article DOI: 10.1021/acs.jmedchem.5b01559 BindingDB Entry DOI: 10.7270/Q2GB25XB
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