Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50138897'   

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))	BDBM50138897 (CHEMBL351123 | Naphthalene-2-sulfonic acid 1-[3-(4...) Show SMILES CN=C(NS(=O)(=O)c1ccc2ccccc2c1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:22| Show InChI InChI=1S/C27H23ClN4O2S/c1-29-27(31-35(33,34)24-16-13-19-7-5-6-10-22(19)17-24)32-18-25(20-8-3-2-4-9-20)26(30-32)21-11-14-23(28)15-12-21/h2-17,25H,18H2,1H3,(H,29,31)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description Displacement of CP-55,940 binding from recombinant human cannabinoid receptor 1 expressed in CHO cells				J Med Chem 47: 627-43 (2004) Article DOI: 10.1021/jm031019q BindingDB Entry DOI: 10.7270/Q2610ZQT
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