BDBM50444573 CHEMBL3099709

SMILES: Cc1cccc(n1)-c1nnc[nH]1

InChI Key: InChIKey=FROWTTVEPOUWQS-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50444573   

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
DNA ligase (Staphylococcus aureus)	BDBM50444573 (CHEMBL3099709) Show SMILES Cc1cccc(n1)-c1nnc[nH]1 Show InChI InChI=1S/C8H8N4/c1-6-3-2-4-7(11-6)8-9-5-10-12-8/h2-5H,1H3,(H,9,10,12)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
Astex Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of C-terminal 6xHis-tagged full length recombinant Staphylococcus aureus DNA ligase (1 to 312) expressed in Escherichia coli BL21 (DE3) us...				ACS Med Chem Lett 4: 1208-12 (2013) Article DOI: 10.1021/ml4003277 BindingDB Entry DOI: 10.7270/Q2J967V2
					More data for this Ligand-Target Pair