Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM169
Substrate
n/a
Meas. Tech.
ChEMBL_157733 (CHEMBL765171)
Ki
0.05±n/a nM
Citation
 De Lucca, GVKim, UTLiang, JCordova, BKlabe, RMGarber, SBacheler, LTLam, GNWright, MRLogue, KAErickson-Viitanen, SKo, SSTrainor, GL Nonsymmetric P2/P2' cyclic urea HIV protease inhibitors. Structure-activity relationship, bioavailability, and resistance profile of monoindazole-substituted P2 analogues. J Med Chem 41:2411-23 (1998) [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:
BDBM169
Synonyms:
(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-3-{[3-(2-hydroxyethyl)phenyl]methyl}-1-(1H-indazol-5-ylmethyl)-1,3-diazepan-2-one | CHEMBL312358 | Cyclic Urea | [4R-(4,5,6,7)]-Hexahydro-5,6-dihydroxy-1-[[3-(2-hydroxyethyl)phenyl]methyl]-3-(1H-indazol-5-ylmethyl)-4,7-bis(phenylmethyl)-2H-1,3-diazepin-2-one
Type:
n/a
Emp. Form.:
C36H38N4O4
Mol. Mass.:
590.7113
SMILES:
OCCc1cccc(CN2[C@H](Cc3ccccc3)[C@H](O)[C@@H](O)[C@@H](Cc3ccccc3)N(Cc3ccc4[nH]ncc4c3)C2=O)c1
Structure:
Search PDB for entries with ligand similarity: