Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50069006
Substrate
n/a
Meas. Tech.
ChEBML_157553
Ki
1500±n/a nM
Citation
 Ghosh, AK; Krishnan, K; Walters, DE; Cho, W; Cho, H; Koo, Y; Trevino, J; Holland, L; Buthod, J Structure based design: novel spirocyclic ethers as nonpeptidal P2-ligands for HIV protease inhibitors. Bioorg Med Chem Lett 8:979-82 (1999) [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:
BDBM50069006
Synonyms:
8-Oxa-spiro[4.5]decane-7-carboxylic acid {(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxy-benzenesulfonyl)-amino]-propyl}-amide | CHEMBL361176
Type:
Small organic molecule
Emp. Form.:
C31H44N2O6S
Mol. Mass.:
572.756
SMILES:
COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)C1CC2(CCCC2)CCO1
Structure:
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