Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetGag-Pol polyprotein [489-587]
LigandBDBM50054181
Substrate/Competitorn/a
Meas. Tech.ChEMBL_160750 (CHEMBL769064)
Ki 0.025±n/a nM
Citation Wilkerson, WWAkamike, ECheatham, WWHollis, AYCollins, RDDeLucca, ILam, PYRu, Y HIV protease inhibitory bis-benzamide cyclic ureas: a quantitative structure-activity relationship analysis. J Med Chem39:4299-312 (1996) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Gag-Pol polyprotein [489-587]
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:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50054181
n/a
NameBDBM50054181
Synonyms:2-{3-[4,7-dibenzyl-5,6-dihydroxy-3-[3-(4-methyl-1,3-thiazol-2-ylcarbamoyl)benzyl]-2-oxo-(4R,5S,6S,7R)-1,3-diazepan-1-ylmethyl]phenylcarboxamido}-4-methyl-1,3-thiazole | CHEMBL86398
TypeSmall organic molecule
Emp. Form.C43H42N6O5S2
Mol. Mass.786.961
SMILESCc1csc(NC(=O)c2cccc(CN3[C@H](Cc4ccccc4)[C@H](O)[C@@H](O)[C@@H](Cc4ccccc4)N(Cc4cccc(c4)C(=O)Nc4nc(C)cs4)C3=O)c2)n1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: