Reaction Details Report a problem with these data
Target
Probable nicotinate-nucleotide adenylyltransferase
Ligand
BDBM33039
Substrate
n/a
IC50
808±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] 
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:
BDBM33039
Synonyms:
2-amino-4-(4-chlorophenyl)-6-(5-methyl-2-furanyl)-3-pyridinecarbonitrile | 2-amino-4-(4-chlorophenyl)-6-(5-methyl-2-furyl)nicotinonitrile | 2-amino-4-(4-chlorophenyl)-6-(5-methylfuran-2-yl)pyridine-3-carbonitrile | 2-azanyl-4-(4-chlorophenyl)-6-(5-methylfuran-2-yl)pyridine-3-carbonitrile | MLS000079802 | SMR000036992 | cid_658940
Type:
Small organic molecule
Emp. Form.:
C17H12ClN3O
Mol. Mass.:
309.75
SMILES:
Cc1ccc(o1)-c1cc(-c2ccc(Cl)cc2)c(C#N)c(N)n1
Structure:
Search PDB for entries with ligand similarity: