Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50082397
Substrate
n/a
Meas. Tech.
ChEBML_79472
Ki
0.130000±n/a nM
Citation
Patel, M; Rodgers, JD; McHugh, RJ; Johnson, BL; Cordova, BC; Klabe, RM; Bacheler, LT; Erickson-Viitanen, S; Ko, SS Unsymmetrical cyclic ureas as HIV-1 protease inhibitors: novel biaryl indazoles as P2/P2' substituents. Bioorg Med Chem Lett 9:3217-20 (1999) [PubMed] Article
More Info.:
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:
BDBM50082397
Synonyms:
(4R,5S,6S,7R)-1-(3-Amino-benzyl)-4,7-dibenzyl-5,6-dihydroxy-3-(3-thiophen-3-yl-1H-indazol-5-ylmethyl)-[1,3]diazepan-2-one | CHEMBL323043
Type:
Small organic molecule
Emp. Form.:
C38H37N5O3S
Mol. Mass.:
643.797
SMILES:
Nc1cccc(CN2[C@H](Cc3ccccc3)[C@H](O)[C@@H](O)[C@@H](Cc3ccccc3)N(Cc3ccc4[nH]nc(-c5ccsc5)c4c3)C2=O)c1