Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50156099'   

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))	BDBM50156099 (CHEMBL3780862) Show SMILES CCCCCn1c2ccc(cc2c(O)c(C(=O)NCc2ccc(OC)cc2)c1=O)-c1cccs1 Show InChI InChI=1S/C27H28N2O4S/c1-3-4-5-14-29-22-13-10-19(23-7-6-15-34-23)16-21(22)25(30)24(27(29)32)26(31)28-17-18-8-11-20(33-2)12-9-18/h6-13,15-16,30H,3-5,14,17H2,1-2H3,(H,28,31)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	159	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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