Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Chondroitin sulfate N-acetylgalactosaminyltransferase 1' and Ligand = 'BDBM50386150'   

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
Chondroitin sulfate N-acetylgalactosaminyltransferase 1 (Homo sapiens (Human))	BDBM50386150 (CHEMBL2042220) Show SMILES CC(C)[C@H](NC(=O)c1nc(no1)-c1ccc(NC(=O)Nc2ccc(F)cc2F)cc1)C(O)=O |r| Show InChI InChI=1S/C21H19F2N5O5/c1-10(2)16(20(30)31)26-18(29)19-27-17(28-33-19)11-3-6-13(7-4-11)24-21(32)25-15-8-5-12(22)9-14(15)23/h3-10,16H,1-2H3,(H,26,29)(H,30,31)(H2,24,25,32)/t16-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.59E+5	n/a	n/a	n/a	n/a	n/a	n/a
Piramal Healthcare Limited Curated by ChEMBL					Assay Description Inhibition of human DGAT1 assessed as conversion of [14C]-oleoyl-CoA to [14C]-triglyceride after 10 mins by scintillation counting				Eur J Med Chem 54: 324-42 (2012) Article DOI: 10.1016/j.ejmech.2012.05.016 BindingDB Entry DOI: 10.7270/Q25B03HK
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