Reaction Details |
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Target | Neuraminidase |
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Ligand | BDBM4714 |
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Substrate/Competitor | BDBM4702 |
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Meas. Tech. | Neuraminidase Inhibition Assay |
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pH | 6.5±n/a |
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Temperature | 310.15±n/a K |
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IC50 | 9000±n/a nM |
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Citation | Chand, P; Babu, YS; Bantia, S; Chu, N; Cole, LB; Kotian, PL; Laver, WG; Montgomery, JA; Pathak, VP; Petty, SL; Shrout, DP; Walsh, DA; Walsh, GM Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design. J Med Chem40:4030-52 (1997) [PubMed] Article |
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More Info.: | Get all data from this article, Solution Info, Assay Method |
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Neuraminidase |
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Name: | Neuraminidase |
Synonyms: | Influenza A Virus Neuraminidase | NA | NRAM_I75A5 | Neuraminidase A |
Type: | Enzyme |
Mol. Mass.: | 52468.81 |
Organism: | Influenza A virus (N9) |
Description: | P03472 |
Residue: | 470 |
Sequence: | MNPNQKILCTSATALVIGTIAVLIGITNLGLNIGLHLKPSCNCSHSQPEATNASQTIINN
YYNDTNITQISNTNIQVEERAIRDFNNLTKGLCTINSWHIYGKDNAVRIGEDSDVLVTRE
PYVSCDPDECRFYALSQGTTIRGKHSNGTIHDRSQYRALISWPLSSPPTVYNSRVECIGW
SSTSCHDGKTRMSICISGPNNNASAVIWYNRRPVTEINTWARNILRTQESECVCHNGVCP
VVFTDGSATGPAETRIYYFKEGKILKWEPLAGTAKHIEECSCYGERAEITCTCRDNWQGS
NRPVIRIDPVAMTHTSQYICSPVLTDNPRPNDPTVGKCNDPYPGNNNNGVKGFSYLDGVN
TWLGRTISIASRSGYEMLKVPNALTDDKSKPTQGQTIVLNTDWSGYSGSFMDYWAEGECY
RACFYVELIRGRPKEDKVWWTSNSIVSMCSSTEFLGQWDWPDGAKIEYFL
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BDBM4714 |
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BDBM4702 |
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Name | BDBM4714 |
Synonyms: | 3-[(Aminoiminomethyl)amino]-4-(aminosulfonyl)benzoic Acid | 3-carbamimidamido-4-sulfamoylbenzoic acid | Benzoic Acid deriv. 164 |
Type | Small organic molecule |
Emp. Form. | C8H10N4O4S |
Mol. Mass. | 258.254 |
SMILES | [#7]\[#6](-[#7])=[#7]/c1cc(ccc1S([#7])(=O)=O)-[#6](-[#8])=O |
Structure |
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