Reaction Details Report a problem with these data
Target
Envelope glycoprotein gp160
Ligand
BDBM95287
Substrate
n/a
IC50
>67044±n/a nM
Citation
 PubChem, PC TRFRET-based biochemical high throughput dose response assay for small molecules that bind to the HIV-1-gp120 binding antibody, PG9 PubChem Bioassay (2012)[AID] 
Target
Name:
Envelope glycoprotein gp160
Synonyms:
ENV_HV1H2 | Envelope polyprotein GP160 | Envelope surface glycoprotein gp160, precursor | HIV-1 B HXB2-LAI-IIIB-BRU | env
Type:
n/a
Mol. Mass.:
97241.93
Organism:
Human immunodeficiency virus type 1 group M subtype B (isolate HXB2)
Description:
n/a
Residue:
856
Sequence:
MRVKEKYQHLWRWGWRWGTMLLGMLMICSATEKLWVTVYYGVPVWKEATTTLFCASDAKAYDTEVHNVWATHACVPTDPNPQEVVLVNVTENFNMWKNDMVEQMHEDIISLWDQSLKPCVKLTPLCVSLKCTDLKNDTNTNSSSGRMIMEKGEIKNCSFNISTSIRGKVQKEYAFFYKLDIIPIDNDTTSYKLTSCNTSVITQACPKVSFEPIPIHYCAPAGFAILKCNNKTFNGTGPCTNVSTVQCTHGIRPVVSTQLLLNGSLAEEEVVIRSVNFTDNAKTIIVQLNTSVEINCTRPNNNTRKRIRIQRGPGRAFVTIGKIGNMRQAHCNISRAKWNNTLKQIASKLREQFGNNKTIIFKQSSGGDPEIVTHSFNCGGEFFYCNSTQLFNSTWFNSTWSTEGSNNTEGSDTITLPCRIKQIINMWQKVGKAMYAPPISGQIRCSSNITGLLLTRDGGNSNNESEIFRPGGGDMRDNWRSELYKYKVVKIEPLGVAPTKAKRRVVQREKRAVGIGALFLGFLGAAGSTMGAASMTLTVQARQLLSGIVQQQNNLLRAIEAQQHLLQLTVWGIKQLQARILAVERYLKDQQLLGIWGCSGKLICTTAVPWNASWSNKSLEQIWNHTTWMEWDREINNYTSLIHSLIEESQNQQEKNEQELLELDKWASLWNWFNITNWLWYIKLFIMIVGGLVGLRIVFAVLSIVNRVRQGYSPLSFQTHLPTPRGPDRPEGIEEEGGERDRDRSIRLVNGSLALIWDDLRSLCLFSYHRLRDLLLIVTRIVELLGRRGWEALKYWWNLLQYWSQELKNSAVSLLNATAIAVAEGTDRVIEVVQGACRAIRHIPRRIRQGLERILL
  
Inhibitor
Name:
BDBM95287
Synonyms:
6-[(2,4-difluorophenyl)sulfamoyl]-4-keto-N-(2-methoxyethyl)-1H-quinoline-3-carboxamide | 6-[(2,4-difluorophenyl)sulfamoyl]-N-(2-methoxyethyl)-4-oxo-1H-quinoline-3-carboxamide | 6-[[2,4-bis(fluoranyl)phenyl]sulfamoyl]-N-(2-methoxyethyl)-4-oxidanylidene-1H-quinoline-3-carboxamide | 6-{[(2,4-difluorophenyl)amino]sulfonyl}-N-(2-methoxyethyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide | MLS001199521 | SMR000560243 | cid_15990602
Type:
Small organic molecule
Emp. Form.:
C19H17F2N3O5S
Mol. Mass.:
437.417
SMILES:
COCCNC(=O)c1cnc2ccc(cc2c1O)S(=O)(=O)Nc1ccc(F)cc1F
Structure:
Search PDB for entries with ligand similarity: