null

SMILES: C[C@@H](O)[C@H](N)C(=O)NS(=O)(=O)c1cccc(c1)-c1ccc2[nH]nc(C)c2c1

InChI Key: InChIKey=QKIYISZIRKNWOU-DIFFPNOSSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50426178   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Threonine--tRNA ligase (Yersinia pestis)	BDBM50426178 (CHEMBL2316960) Show SMILES C[C@@H](O)[C@H](N)C(=O)NS(=O)(=O)c1cccc(c1)-c1ccc2[nH]nc(C)c2c1 |r| Show InChI InChI=1S/C18H20N4O4S/c1-10-15-9-13(6-7-16(15)21-20-10)12-4-3-5-14(8-12)27(25,26)22-18(24)17(19)11(2)23/h3-9,11,17,23H,19H2,1-2H3,(H,20,21)(H,22,24)/t11-,17+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	83	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trius Therapeutics, Inc. Curated by ChEMBL					Assay Description Binding affinity to Yersinia pestis ThrRS by coupled spectrophotometry				J Med Chem 56: 1748-60 (2013) Article DOI: 10.1021/jm301756m BindingDB Entry DOI: 10.7270/Q2GQ7036
					More data for this Ligand-Target Pair
Threonine--tRNA ligase 1, cytoplasmic (Homo sapiens (Human))	BDBM50426178 (CHEMBL2316960) Show SMILES C[C@@H](O)[C@H](N)C(=O)NS(=O)(=O)c1cccc(c1)-c1ccc2[nH]nc(C)c2c1 |r| Show InChI InChI=1S/C18H20N4O4S/c1-10-15-9-13(6-7-16(15)21-20-10)12-4-3-5-14(8-12)27(25,26)22-18(24)17(19)11(2)23/h3-9,11,17,23H,19H2,1-2H3,(H,20,21)(H,22,24)/t11-,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.82E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Trius Therapeutics, Inc. Curated by ChEMBL					Assay Description Binding affinity to human cytoplasmic ThrRS by coupled spectrophotometry				J Med Chem 56: 1748-60 (2013) Article DOI: 10.1021/jm301756m BindingDB Entry DOI: 10.7270/Q2GQ7036
					More data for this Ligand-Target Pair