Reaction Details
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Probable nicotinate-nucleotide adenylyltransferase
Ligand
BDBM88679
Substrate
n/a
IC50
11700±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:
BDBM88679
Synonyms:
(7E)-7-[(2E)-2-(6-ethoxy-1-methyl-2-quinolinylidene)ethylidene]-5-methyl-8-quinolin-1-iumone;iodide | (7E)-7-[(2E)-2-(6-ethoxy-1-methyl-2-quinolylidene)ethylidene]-5-methyl-quinolin-1-ium-8-one;iodide | (7E)-7-[(2E)-2-(6-ethoxy-1-methyl-quinolin-2-ylidene)ethylidene]-5-methyl-quinolin-1-ium-8-one;iodide | (7E)-7-[(2E)-2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]-5-methylquinolin-1-ium-8-one;iodide | MLS002702523 | Quinolinium, 6-ethoxy-2-[2-(8-hydroxy-5-methyl-7-quinolyl)vinyl]-1-methyl- iodide | SMR001566135 | cid_45281152
Type:
Small organic molecule
Emp. Form.:
C24H23N2O2
Mol. Mass.:
371.4511
SMILES:
CCOc1ccc2N(C)\C(=C\C=C3/C=C(C)c4ccc[nH+]c4C3=O)C=Cc2c1 |c:26,t:13|
Structure:
