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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM589
Substrate
n/a
Meas. Tech.
ChEBML_159622
IC50
3±n/a nM
Citation
 Humber, DC; Cammack, N; Coates, JA; Cobley, KN; Orr, DC; Storer, R; Weingarten, GG; Weir, MP Penicillin derived C2-symmetric dimers as novel inhibitors of HIV-1 proteinase. J Med Chem 35:3080-1 (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:
BDBM589
Synonyms:
(2R,4S)-2-[(R)-carbamoyl(1-phenylacetamido)methyl]-N-(2-{[(2R,4S)-2-[(R)-carbamoyl(1-phenylacetamido)methyl]-5,5-dimethyl-1,3-thiazolidin-4-yl]formamido}ethyl)-5,5-dimethyl-1,3-thiazolidine-4-carboxamide | CHEMBL105695 | penicillin Et(NH)2 Sym dimer | penicillin deriv. 2
Type:
Small organic molecule
Emp. Form.:
C34H46N8O6S2
Mol. Mass.:
726.909
SMILES:
[H][C@]1(N[C@@H](C(=O)NCCNC(=O)[C@@H]2N[C@]([H])(SC2(C)C)[C@H](NC(=O)Cc2ccccc2)C(N)=O)C(C)(C)S1)[C@H](NC(=O)Cc1ccccc1)C(N)=O |r|
Structure:
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