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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gag-Pol polyprotein [489-587]' and Ligand = 'BDBM50282005'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM50282005
PNG
(((S)-5-tert-Butylcarbamoyl-3-hydroxy-1-isobutyl-py...)
Show SMILES CC(C)CN1CC(O)(CNC(=O)OC(C)(C)C)C[C@H]1C(=O)NC(C)(C)C
Show InChI InChI=1S/C19H37N3O4/c1-13(2)10-22-12-19(25,11-20-16(24)26-18(6,7)8)9-14(22)15(23)21-17(3,4)5/h13-14,25H,9-12H2,1-8H3,(H,20,24)(H,21,23)/t14-,19?/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a>9.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against HIV-1 proteinase


Bioorg Med Chem Lett 3: 1485-1491 (1993)


Article DOI: 10.1016/S0960-894X(00)80004-9
BindingDB Entry DOI: 10.7270/Q2NV9J5D
More data for this
Ligand-Target Pair