Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50056331'   

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))	BDBM50056331 (CHEMBL3322468) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCCCCCCNC(=O)C12CC3CC(C1)CC(C3)(C2)C(=O)NCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |TLB:38:37:44:40.39.41,38:39:36.37.43:44,THB:41:39:36:43.42.44,41:42:36:40.38.39,45:42:36:40.38.39| Show InChI InChI=1S/C62H70Cl6N8O4/c1-39-53(73-75(51-25-23-47(65)32-49(51)67)55(39)43-15-19-45(63)20-16-43)57(77)69-27-11-7-3-5-9-13-29-71-59(79)61-34-41-31-42(35-61)37-62(36-41,38-61)60(80)72-30-14-10-6-4-8-12-28-70-58(78)54-40(2)56(44-17-21-46(64)22-18-44)76(74-54)52-26-24-48(66)33-50(52)68/h15-26,32-33,41-42H,3-14,27-31,34-38H2,1-2H3,(H,69,77)(H,70,78)(H,71,79)(H,72,80)	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	7.24E+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))	BDBM50056331 (CHEMBL3322468) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NCCCCCCCCNC(=O)C12CC3CC(C1)CC(C3)(C2)C(=O)NCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |TLB:38:37:44:40.39.41,38:39:36.37.43:44,THB:41:39:36:43.42.44,41:42:36:40.38.39,45:42:36:40.38.39| Show InChI InChI=1S/C62H70Cl6N8O4/c1-39-53(73-75(51-25-23-47(65)32-49(51)67)55(39)43-15-19-45(63)20-16-43)57(77)69-27-11-7-3-5-9-13-29-71-59(79)61-34-41-31-42(35-61)37-62(36-41,38-61)60(80)72-30-14-10-6-4-8-12-28-70-58(78)54-40(2)56(44-17-21-46(64)22-18-44)76(74-54)52-26-24-48(66)33-50(52)68/h15-26,32-33,41-42H,3-14,27-31,34-38H2,1-2H3,(H,69,77)(H,70,78)(H,71,79)(H,72,80)	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	7.24E+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