Reaction Details
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Probable nicotinate-nucleotide adenylyltransferase
Ligand
BDBM51991
Substrate
n/a
IC50
15800±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:
BDBM51991
Synonyms:
3-[[(E)-[2-(3-bromobenzyl)oxybenzylidene]amino]thiocarbamoylamino]benzoic acid | 3-[[[2-(3-bromobenzyl)oxybenzylidene]amino]thiocarbamoylamino]benzoic acid | 3-[[[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]carbamothioylamino]benzoic acid | 3-[[[2-[[2-[(3-bromophenyl)methoxy]phenyl]methylidene]hydrazinyl]-sulfanylidenemethyl]amino]benzoic acid | 3-{[(2-{2-[(3-bromobenzyl)oxy]benzylidene}hydrazino)carbonothioyl]amino}benzoic acid | MLS000681697 | SMR000312741 | cid_16195447
Type:
Small organic molecule
Emp. Form.:
C22H18BrN3O3S
Mol. Mass.:
484.366
SMILES:
OC(=O)c1cccc(NC(=S)NN=Cc2ccccc2OCc2cccc(Br)c2)c1 |w:12.11|
Structure:
