BDBM50378440 CHEMBL571734

SMILES: Cc1cnc(nc1)-c1cc(cc2nc(NC(=O)NC3CC3)cn12)-c1cccnc1

InChI Key: InChIKey=WKJAKTPELBFZGV-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50378440   

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 topoisomerase (ATP-hydrolyzing) (Streptococcus pneumoniae)	BDBM50378440 (CHEMBL571734) Show SMILES Cc1cnc(nc1)-c1cc(cc2nc(NC(=O)NC3CC3)cn12)-c1cccnc1 Show InChI InChI=1S/C21H19N7O/c1-13-9-23-20(24-10-13)17-7-15(14-3-2-6-22-11-14)8-19-26-18(12-28(17)19)27-21(29)25-16-4-5-16/h2-3,6-12,16H,4-5H2,1H3,(H2,25,27,29)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	571	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of Streptococcus pneumoniae SP-3 parE after 30 mins				Bioorg Med Chem Lett 19: 5302-6 (2009) Article DOI: 10.1016/j.bmcl.2009.07.141 BindingDB Entry DOI: 10.7270/Q23X87KD
					More data for this Ligand-Target Pair
DNA gyrase subunit B (Streptococcus pneumoniae)	BDBM50378440 (CHEMBL571734) Show SMILES Cc1cnc(nc1)-c1cc(cc2nc(NC(=O)NC3CC3)cn12)-c1cccnc1 Show InChI InChI=1S/C21H19N7O/c1-13-9-23-20(24-10-13)17-7-15(14-3-2-6-22-11-14)8-19-26-18(12-28(17)19)27-21(29)25-16-4-5-16/h2-3,6-12,16H,4-5H2,1H3,(H2,25,27,29)	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	295	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of Streptococcus pneumoniae SP-3 gyrB by enzyme coupled phosphate assay				Bioorg Med Chem Lett 19: 5302-6 (2009) Article DOI: 10.1016/j.bmcl.2009.07.141 BindingDB Entry DOI: 10.7270/Q23X87KD
					More data for this Ligand-Target Pair