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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 = 'BDBM50410037'   
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)		BDBM50410037
PNG
(CHEMBL178277)
Show SMILES O[C@@H]1[C@@H](CCc2ccccc2)N(C(=O)N([C@@H]1Cc1ccccc1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C31H30N2O2/c34-30-28(22-21-24-13-5-1-6-14-24)32(26-17-9-3-10-18-26)31(35)33(27-19-11-4-12-20-27)29(30)23-25-15-7-2-8-16-25/h1-20,28-30,34H,21-23H2/t28-,29-,30-/m1/s1
PDB
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PC cid
PC sid
UniChem

Similars
Article
PubMed
 15.1n/an/an/an/an/an/an/an/a



Clarkson University

Curated by ChEMBL


Assay Description
Antiviral activity potency was assessed by measuring effect on the accumulation of viral RNA transcripts 3 days after infection of MT-2 cells with HI...

Bioorg Med Chem Lett 15: 3767-70 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.087
BindingDB Entry DOI: 10.7270/Q2SQ91KF
More data for this
Ligand-Target Pair