BDBM50210344 BROMODEOXYTOPSENTIN

SMILES: Brc1ccc2c(c[nH]c2c1)-c1cnc([nH]1)C(=O)c1c[nH]c2ccccc12

InChI Key: InChIKey=RMAWSNVDVKZXDX-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 = 50210344   

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
Sortase A (SrtA) (Staphylococcus aureus)	BDBM50210344 (BROMODEOXYTOPSENTIN) Show SMILES Brc1ccc2c(c[nH]c2c1)-c1cnc([nH]1)C(=O)c1c[nH]c2ccccc12 Show InChI InChI=1S/C20H13BrN4O/c21-11-5-6-13-14(8-23-17(13)7-11)18-10-24-20(25-18)19(26)15-9-22-16-4-2-1-3-12(15)16/h1-10,22-23H,(H,24,25)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Inhibitory activity against Sortase A from Staphylococcus aureus				Bioorg Med Chem Lett 15: 4927-31 (2005) Article DOI: 10.1016/j.bmcl.2005.08.021 BindingDB Entry DOI: 10.7270/Q2QN69HD
					More data for this Ligand-Target Pair
Pyruvate kinase (Staphylococcus aureus (strain MRSA252))	BDBM50210344 (BROMODEOXYTOPSENTIN) Show SMILES Brc1ccc2c(c[nH]c2c1)-c1cnc([nH]1)C(=O)c1c[nH]c2ccccc12 Show InChI InChI=1S/C20H13BrN4O/c21-11-5-6-13-14(8-23-17(13)7-11)18-10-24-20(25-18)19(26)15-9-22-16-4-2-1-3-12(15)16/h1-10,22-23H,(H,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Simon Fraser University Curated by ChEMBL					Assay Description Inhibition of recombinant N-terminal His-tagged methicillin-resistant Staphylococcus aureus MRSA252 pyruvate kinase expressed in Escherichia coli BL2...				Eur J Med Chem 125: 1-13 (2017) Article DOI: 10.1016/j.ejmech.2016.09.018 BindingDB Entry DOI: 10.7270/Q2CC12P0
					More data for this Ligand-Target Pair