| Reaction Details |
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 | Report a problem with these data |
| Target | Probable nicotinate-nucleotide adenylyltransferase |
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| Ligand | BDBM95173 |
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| Substrate/Competitor | n/a |
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| IC50 | 15700±n/a nM |
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| Citation |  PubChem, PC Dose response confirmation of uHTS inhibitor hits from NadD in a Colorimetric assay - Set 2 PubChem Bioassay(2012)[AID] |
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| More Info.: | Get all data from this article |
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| Probable nicotinate-nucleotide adenylyltransferase |
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| Name: | Probable nicotinate-nucleotide adenylyltransferase |
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| Synonyms: | NADD_STAAN | hypothetical protein SA1422 | nadD |
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| Type: | Enzyme Catalytic Domain |
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| Mol. Mass.: | 22100.53 |
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| Organism: | Staphylococcus aureus subsp. aureus N315 |
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| Description: | gi_15927174 |
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| Residue: | 189 |
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| Sequence: | MKKIVLYGGQFNPIHTAHMIVASEVFHELQPDEFYFLPSFMSPLKKHNNFIDVQHRLTMI
QMIIDELGFGDICDDEIKRGGQSYTYDTIKAFKEQHKDSELYFVIGTDQYNQLEKWYQIE
YLKEMVTFVVVNRDKNSQNVENAMIAIQIPRVDISSTMIRQRVSEGKSIQVLVPKSVENY
IKGEGLYEH
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| BDBM95173 |
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| n/a |
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| Name | BDBM95173 |
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| Synonyms: | MLS000438847 | SMR000452599 | [3-(4-cyanophenyl)-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] cyclopentanecarboxylate | [3-(4-cyanophenyl)-7-methyl-6,8-dioxoisochromen-7-yl] cyclopentanecarboxylate | cid_16759476 | cyclopentanecarboxylic acid [3-(4-cyanophenyl)-6,8-diketo-7-methyl-isochromen-7-yl] ester | cyclopentanecarboxylic acid [3-(4-cyanophenyl)-7-methyl-6,8-dioxo-2-benzopyran-7-yl] ester |
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| Type | Small organic molecule |
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| Emp. Form. | C23H19NO5 |
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| Mol. Mass. | 389.4007 |
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| SMILES | CC1(OC(=O)C2CCCC2)C(=O)C=C2C=C(OC=C2C1=O)c1ccc(cc1)C#N |c:15,18,t:13| |
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| Structure | 
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