Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50061405
Substrate
n/a
Meas. Tech.
ChEMBL_159973 (CHEMBL768120)
Ki
0.016±n/a nM
Citation
 Wilkerson, WW; Dax, S; Cheatham, WW Nonsymmetrically substituted cyclic urea HIV protease inhibitors. J Med Chem 40:4079-88 (1998) [PubMed]  Article 
Target
Name:
Gag-Pol polyprotein [489-587]
Synonyms:
Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
10781.16
Organism:
Human immunodeficiency virus type 1
Description:
P04585[489-587]
Residue:
99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50061405
Synonyms:
3-[(4R,5S,6S,7R)-3-(3-Amino-benzyl)-4,7-dibenzyl-5,6-dihydroxy-2-oxo-[1,3]diazepan-1-ylmethyl]-N-pyrazin-2-yl-benzamide | CHEMBL133291
Type:
Small organic molecule
Emp. Form.:
C38H38N6O4
Mol. Mass.:
642.7461
SMILES:
Nc1cccc(CN2[C@H](Cc3ccccc3)[C@H](O)[C@@H](O)[C@@H](Cc3ccccc3)N(Cc3cccc(c3)C(=O)Nc3cnccn3)C2=O)c1
Structure:
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