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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 = 'BDBM50285897'   
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)
BDBM50285897
PNG
(CHEMBL273562 | [(1S,3S,4S)-1-Benzyl-3-hydroxy-4-(3...)
Show SMILES CC(C)(C)OC(=O)N[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(O)c1)Cc1ccccc1
Show InChI InChI=1S/C30H36N2O5/c1-30(2,3)37-29(36)31-24(17-21-11-6-4-7-12-21)20-27(34)26(18-22-13-8-5-9-14-22)32-28(35)23-15-10-16-25(33)19-23/h4-16,19,24,26-27,33-34H,17-18,20H2,1-3H3,(H,31,36)(H,32,35)/t24-,26-,27-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

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

Similars

Article
n/an/a 3.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against purified HIV protease


Bioorg Med Chem Lett 5: 2725-2728 (1995)


Article DOI: 10.1016/0960-894X(95)00462-3
BindingDB Entry DOI: 10.7270/Q26973JN
More data for this
Ligand-Target Pair