Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cysteine synthase' and Ligand = 'BDBM50423698'   

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...)	BDBM50423698 (CHEMBL568987) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)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/C33H46N6O8S/c1-4-19(2)28(33(46)47)39-32(45)25(16-20-8-6-5-7-9-20)38-30(43)24(17-21-10-12-22(40)13-11-21)37-31(44)26(18-27(35)41)36-29(42)23(34)14-15-48-3/h5-13,19,23-26,28,40H,4,14-18,34H2,1-3H3,(H2,35,41)(H,36,42)(H,37,44)(H,38,43)(H,39,45)(H,46,47)/t19-,23-,24-,25-,26-,28-/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	1.91E+5	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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