Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cysteine synthase' and Ligand = 'BDBM50423697'   

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
Cysteine synthase (Haemophilus influenzae (strain ATCC 51907 / DSM 11...)	BDBM50423697 (CHEMBL568986) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCSC)C(O)=O |r| Show InChI InChI=1S/C27H42N6O9S/c1-4-14(2)22(27(41)42)33-26(40)20(13-34)32-24(38)18(11-15-5-7-16(35)8-6-15)31-25(39)19(12-21(29)36)30-23(37)17(28)9-10-43-3/h5-8,14,17-20,22,34-35H,4,9-13,28H2,1-3H3,(H2,29,36)(H,30,37)(H,31,39)(H,32,38)(H,33,40)(H,41,42)/t14-,17-,18-,19-,20-,22-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	6.03E+4	n/a	n/a	n/a	n/a	n/a
University of Parma Curated by ChEMBL					Assay Description Binding affinity to Haemophilus influenzae O-acetylserine sulfhydrylase expressed in Escherichia coli BL21 (DE3) by fluorescence emission spectra ana...				J Med Chem 53: 345-56 (2010) Article DOI: 10.1021/jm901325e BindingDB Entry DOI: 10.7270/Q2QZ2C8P
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