Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50380852'   

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))	BDBM50380852 (CHEMBL2018656) Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(O)=O Show InChI InChI=1S/C23H34N2O4/c1-23(2,22(28)29)24-20(26)18-14-17-12-8-3-4-9-13-19(17)25(21(18)27)15-16-10-6-5-7-11-16/h14,16H,3-13,15H2,1-2H3,(H,24,26)(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from recombinant human CB1 receptor by scatchard plot analysis				Bioorg Med Chem Lett 22: 2894-7 (2012) Article DOI: 10.1016/j.bmcl.2012.02.054 BindingDB Entry DOI: 10.7270/Q2NV9K85
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50380852 (CHEMBL2018656) Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(O)=O Show InChI InChI=1S/C23H34N2O4/c1-23(2,22(28)29)24-20(26)18-14-17-12-8-3-4-9-13-19(17)25(21(18)27)15-16-10-6-5-7-11-16/h14,16H,3-13,15H2,1-2H3,(H,24,26)(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB1 receptor membrane fractions				Bioorg Med Chem Lett 22: 2898-901 (2012) Article DOI: 10.1016/j.bmcl.2012.02.050 BindingDB Entry DOI: 10.7270/Q2Q81F30
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50380852 (CHEMBL2018656) Show SMILES CC(C)(NC(=O)c1cc2CCCCCCc2n(CC2CCCCC2)c1=O)C(O)=O Show InChI InChI=1S/C23H34N2O4/c1-23(2,22(28)29)24-20(26)18-14-17-12-8-3-4-9-13-19(17)25(21(18)27)15-16-10-6-5-7-11-16/h14,16H,3-13,15H2,1-2H3,(H,24,26)(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant CB1 receptor after 60 mins				Bioorg Med Chem Lett 22: 2803-6 (2012) Article DOI: 10.1016/j.bmcl.2012.02.072 BindingDB Entry DOI: 10.7270/Q2DB82VV
					More data for this Ligand-Target Pair