Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50541873
Substrate
n/a
Meas. Tech.
ChEMBL_1985519 (CHEMBL4618925)
Ki
0.860000±n/a nM
Citation
 Zhu, M; Dou, Y; Ma, L; Dong, B; Zhang, F; Zhang, G; Wang, J; Zhou, J; Cen, S; Wang, Y Novel HIV-1 Protease Inhibitors with Morpholine as the P2 Ligand to Enhance Activity against DRV-Resistant Variants. ACS Med Chem Lett 11:1196-1204 (2020) [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:
BDBM50541873
Synonyms:
CHEMBL4645562
Type:
Small organic molecule
Emp. Form.:
C27H40N4O6S
Mol. Mass.:
548.695
SMILES:
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OCCN1CCOCC1)S(=O)(=O)c1ccc(N)cc1 |r|
Structure:
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