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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50008681
Substrate
n/a
Meas. Tech.
ChEBML_159125
IC50
21000±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:
BDBM50008681
Synonyms:
4-{2-[9-(Benzylamino-methyl)-6,10-dioxo-1,4,7,8,9,10-hexahydro-6H-pyridazino[1,2-a][1,2]diazepin-1-yl]-acetylamino}-3-hydroxy-6-methyl-heptanoic acid [1-(1-carbamoyl-2-phenyl-ethylcarbamoyl)-2-methyl-butyl]-amide | CHEMBL325180
Type:
Small organic molecule
Emp. Form.:
C42H59N7O7
Mol. Mass.:
773.9606
SMILES:
CCC(C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)CC1C=CCN2N1C(=O)C(CNCc1ccccc1)CCC2=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |c:21|
Structure:
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