Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50605056
Substrate
n/a
Meas. Tech.
ChEMBL_2250263 (CHEMBL5164473)
IC50
2000±n/a nM
Citation
 Kojima, EIimuro, ANakajima, MKinuta, HAsada, NSako, YNakata, ZUemura, KArita, SMiki, SWakasa-Morimoto, CTachibana, Y Pocket-to-Lead: Structure-Based  J Med Chem 65:6157-6170 (2022) [PubMed] 
Target
Name:
Gag-Pol polyprotein [489-587]
Synonyms:
Human immunodeficiency virus type 1 protease | Pol polyprotein | POL_HV1H2 | 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:
BDBM50605056
Synonyms:
CHEMBL5198345
Type:
Small organic molecule
Emp. Form.:
C24H31NO5S
Mol. Mass.:
445.58
SMILES:
COc1ccc(CN2C[C@H](O)[C@@](CCC(C)C)(c3ccc(S(C)(=O)=O)cc3)C2=O)cc1
Structure:
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