Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50056318'   

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))	BDBM50056318 (CHEMBL3322350) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCCCCCN(CCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)Cc1ccccc1 Show InChI InChI=1S/C55H57Cl6N7O2/c1-37-50(64-67(48-28-26-44(58)34-46(48)60)52(37)40-18-22-42(56)23-19-40)54(69)62-30-12-5-3-7-14-32-66(36-39-16-10-9-11-17-39)33-15-8-4-6-13-31-63-55(70)51-38(2)53(41-20-24-43(57)25-21-41)68(65-51)49-29-27-45(59)35-47(49)61/h9-11,16-29,34-35H,3-8,12-15,30-33,36H2,1-2H3,(H,62,69)(H,63,70)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.85E+3	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Inverse agonist activity at human CB1 receptor expressed in Sf9 cells coexpressing Gbeta1gamma2 and RSG4 assessed as degradation of [gamma-33P]GTP af...				Bioorg Med Chem Lett 24: 4209-14 (2014) Article DOI: 10.1016/j.bmcl.2014.07.038 BindingDB Entry DOI: 10.7270/Q26M38HV
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50056318 (CHEMBL3322350) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCCCCCN(CCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)Cc1ccccc1 Show InChI InChI=1S/C55H57Cl6N7O2/c1-37-50(64-67(48-28-26-44(58)34-46(48)60)52(37)40-18-22-42(56)23-19-40)54(69)62-30-12-5-3-7-14-32-66(36-39-16-10-9-11-17-39)33-15-8-4-6-13-31-63-55(70)51-38(2)53(41-20-24-43(57)25-21-41)68(65-51)49-29-27-45(59)35-47(49)61/h9-11,16-29,34-35H,3-8,12-15,30-33,36H2,1-2H3,(H,62,69)(H,63,70)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.89E+3	n/a	n/a	n/a	n/a
Julius-Maximilians-Universit£t W£rzburg Curated by ChEMBL					Assay Description Inverse agonist activity at human CB1 receptor expressed in Sf9 cells coexpressing Gbeta1gamma2 and RSG4 assessed as degradation of [gamma-33P]GTP af...				Bioorg Med Chem Lett 24: 4209-14 (2014) Article DOI: 10.1016/j.bmcl.2014.07.038 BindingDB Entry DOI: 10.7270/Q26M38HV
					More data for this Ligand-Target Pair