BDBM98111 1-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-3-(3-nitrophenyl)urea::Compound ID 7{2,7}

SMILES: [O-][N+](=O)c1cccc(NC(=O)Nc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)c1

InChI Key: InChIKey=PMYVVYWZPIOOTK-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 = 98111   

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
Nicotinate-nucleotide adenylyltransferase (NadD) (Bacillus anthracis)	BDBM98111 (1-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-3-(3-n...) Show SMILES [O-][N+](=O)c1cccc(NC(=O)Nc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)c1 Show InChI InChI=1S/C19H15FN4O5S/c20-13-4-10-18(11-5-13)30(28,29)23-15-8-6-14(7-9-15)21-19(25)22-16-2-1-3-17(12-16)24(26)27/h1-12,23H,(H2,21,22,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	7.5	0
University of Alabama at Birmingham					Assay Description Inhibitory concentration of the compound measured against B. anthracis Nicotinic acid mononucleotide adenylyltransferase (NaMNAT)using HPLC Enzyme As...				J Comb Chem 11: 617-25 (2009) Article DOI: 10.1021/cc9000357 BindingDB Entry DOI: 10.7270/Q2K35S9C
					More data for this Ligand-Target Pair
Nicotinamide adenine dinucleotide synthetase (NADs) (Bacillus anthracis)	BDBM98111 (1-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-3-(3-n...) Show SMILES [O-][N+](=O)c1cccc(NC(=O)Nc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)c1 Show InChI InChI=1S/C19H15FN4O5S/c20-13-4-10-18(11-5-13)30(28,29)23-15-8-6-14(7-9-15)21-19(25)22-16-2-1-3-17(12-16)24(26)27/h1-12,23H,(H2,21,22,25)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.63E+5	n/a	n/a	n/a	n/a	8.5	4
University of Alabama at Birmingham					Assay Description Inhibitory concentration of the compound measured against B. anthracis Nicotinamide adenine dinucleotide synthetase (NADs) using HPLC Enzyme Assay				J Comb Chem 11: 617-25 (2009) Article DOI: 10.1021/cc9000357 BindingDB Entry DOI: 10.7270/Q2K35S9C
					More data for this Ligand-Target Pair