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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50008679
Substrate
n/a
Meas. Tech.
ChEBML_159125
IC50
26±n/a nM
Citation
 Kahn, M; Nakanishi, H; Chrusciel, RA; Fitzpatrick, D; Johnson, ME Examination of HIV-1 protease secondary structure specificity using conformationally constrained inhibitors. J Med Chem 34:3395-9 (1992) [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:
BDBM50008679
Synonyms:
4-[2-(9-Aminomethyl-6,10-dioxo-octahydro-pyridazino[1,2-a][1,2]diazepin-1-yl)-acetylamino]-5-cyclohexyl-3-hydroxy-pentanoic acid [1-(1-carbamoyl-2-phenyl-ethylcarbamoyl)-2-methyl-butyl]-amide | CHEMBL324989
Type:
Small organic molecule
Emp. Form.:
C38H59N7O7
Mol. Mass.:
725.9178
SMILES:
CCC(C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CC1CCCN2N1C(=O)C(CN)CCC2=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Structure:
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