Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50067733'   

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))	BDBM50067733 (6-((6aR,10aR)-1-Hydroxy-6,6,9-trimethyl-6a,7,10,10...) Show SMILES CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(cc1OC2(C)C)C(C)(C)CCCCC(=O)Nc1ccc(Cl)cc1Cl |t:1| Show InChI InChI=1S/C30H37Cl2NO3/c1-18-9-11-22-21(14-18)28-25(34)15-19(16-26(28)36-30(22,4)5)29(2,3)13-7-6-8-27(35)33-24-12-10-20(31)17-23(24)32/h9-10,12,15-17,21-22,34H,6-8,11,13-14H2,1-5H3,(H,33,35)/t21-,22-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organix, Inc. Curated by ChEMBL					Assay Description Evaluated for its binding affinity towards Cannabinoid receptor 1 (CB1)				J Med Chem 41: 4400-7 (1998) Article DOI: 10.1021/jm9803875 BindingDB Entry DOI: 10.7270/Q2M909CZ
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