Reaction Details |
| Report a problem with these data |
Target | Neuraminidase |
---|
Ligand | BDBM4707 |
---|
Substrate/Competitor | BDBM4702 |
---|
Meas. Tech. | Neuraminidase Inhibition Assay |
---|
pH | 6.5±n/a |
---|
Temperature | 310.15±n/a K |
---|
IC50 | 2500±n/a nM |
---|
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 |
---|
More Info.: | Get all data from this article, Solution Info, Assay Method |
---|
|
Neuraminidase |
---|
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
|
|
|
BDBM4707 |
---|
BDBM4702 |
---|
Name | BDBM4707 |
Synonyms: | 3-(2,2-diaminoimino)-4-methylcarboxamidobenzoate | 3-carbamimidamido-4-acetamidobenzoic acid | 4-Acetylamino-3-guanidino-benzoic acid | 4-acetamido-3-(diaminomethyleneamino)benzoic acid | BANA 113 | CHEMBL55440 |
Type | Small organic molecule |
Emp. Form. | C10H12N4O3 |
Mol. Mass. | 236.2273 |
SMILES | [#6]-[#6](=O)-[#7]-c1ccc(cc1\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |
Structure |
|