Reaction Details
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Probable nicotinate-nucleotide adenylyltransferase
Ligand
BDBM95192
Substrate
n/a
IC50
17400±n/a nM
Citation
PubChem, PC Dose response confirmation of uHTS inhibitor hits from NadD in a Colorimetric assay - Set 2 PubChem Bioassay (2012)[AID] More Info.:
Target
Name:
Probable nicotinate-nucleotide adenylyltransferase
Synonyms:
NADD_STAAN | hypothetical protein SA1422 | nadD
Type:
Enzyme Catalytic Domain
Mol. Mass.:
22100.53
Organism:
Staphylococcus aureus subsp. aureus N315
Description:
gi_15927174
Residue:
189
Sequence:
MKKIVLYGGQFNPIHTAHMIVASEVFHELQPDEFYFLPSFMSPLKKHNNFIDVQHRLTMIQMIIDELGFGDICDDEIKRGGQSYTYDTIKAFKEQHKDSELYFVIGTDQYNQLEKWYQIEYLKEMVTFVVVNRDKNSQNVENAMIAIQIPRVDISSTMIRQRVSEGKSIQVLVPKSVENYIKGEGLYEH
Inhibitor
Name:
BDBM95192
Synonyms:
4-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide | 4-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]amino]-N-(2-thiazolyl)benzenesulfonamide | 4-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide | 4-[[(Z)-[1-(3,4-dimethylphenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]amino]-N-thiazol-2-yl-benzenesulfonamide | 4-{[1-(3,4-Dimethyl-phenyl)-3-methyl-5-oxo-1,5-dihydro-pyrazol-4-ylidenemethyl]-amino}-N-thiazol-2-yl-benzenesulfonamide | MLS000554552 | SMR000171528 | cid_5341389
Type:
Small organic molecule
Emp. Form.:
C22H21N5O3S2
Mol. Mass.:
467.564
SMILES:
Cc1[nH]n(-c2ccc(C)c(C)c2)c(=O)c1C=Nc1ccc(cc1)S(=O)(=O)Nc1nccs1 |w:16.18|
Structure:
