Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50332892'   

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))	BDBM50332892 (1-(2,4-Dichlorophenyl)-5-(2,5-dimethyl-1H-pyrrol-1...) Show SMILES CCC(C)(C)NC(=O)c1nn(c(c1C)-n1c(C)ccc1C)-c1ccc(Cl)cc1Cl |(13.97,-1.89,;13.2,-3.22,;11.66,-3.23,;10.32,-3.98,;11.65,-4.76,;10.89,-1.9,;9.34,-1.9,;8.58,-.58,;8.56,-3.25,;8.98,-4.72,;7.71,-5.58,;6.51,-4.61,;7.05,-3.18,;6.22,-1.87,;4.97,-4.7,;4.05,-3.45,;4.51,-1.98,;2.61,-3.93,;2.6,-5.46,;4.08,-5.93,;4.55,-7.4,;7.7,-7.12,;6.38,-7.89,;6.37,-9.44,;7.71,-10.21,;7.71,-11.75,;9.04,-9.44,;9.04,-7.89,;10.39,-7.1,)| Show InChI InChI=1S/C22H26Cl2N4O/c1-7-22(5,6)25-20(29)19-15(4)21(27-13(2)8-9-14(27)3)28(26-19)18-11-10-16(23)12-17(18)24/h8-12H,7H2,1-6H3,(H,25,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	194	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Displacement of [3H]CP-55,940 from recombinant human CB1 receptor transfected in HEK cells				Eur J Med Chem 45: 5878-86 (2010) Article DOI: 10.1016/j.ejmech.2010.09.053 BindingDB Entry DOI: 10.7270/Q22Z15T3
					More data for this Ligand-Target Pair