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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Protein Tat' and Ligand = 'BDBM50407488'   
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
Protein Tat


(Human immunodeficiency virus type 1 (isolate PCV12...)
BDBM50407488
PNG
(CHEMBL3137916)
Show SMILES [H][C@]12O[C@]11CC[C@@]3([H])[C@]4([H])CC[C@H](OC(C)=O)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC(C(=O)OC)C2=O
Show InChI InChI=1S/C23H32O6/c1-12(24)28-17-6-5-15-13-7-10-23-19(29-23)18(25)14(20(26)27-4)11-22(23,3)16(13)8-9-21(15,17)2/h13-17,19H,5-11H2,1-4H3/t13-,14?,15-,16-,17-,19+,21-,22+,23+/m0/s1
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PubMed
n/an/a 2.70E+3n/an/an/an/an/an/a



Sterling Winthrop Pharmaecuticals Research Division

Curated by ChEMBL


Assay Description
The compound was tested for inhibition of HIV-1 replication in SW480 cells using HIV tat assay


J Med Chem 38: 3197-206 (1995)


BindingDB Entry DOI: 10.7270/Q27D2WBX
More data for this
Ligand-Target Pair