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Found 1 hit Enz. Inhib. hit(s) with Target = 'Gag-Pol polyprotein [489-587]' and Ligand = 'BDBM50053904'   
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)		BDBM50053904
PNG
(4-Cyano-N-{3-[1-(4-hydroxy-2-oxo-2,4a,5,6,7,7a-hex...)
Show SMILES CCC(C1C(=O)OC2CCCC2C1=O)c1cccc(NS(=O)(=O)c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C24H24N2O5S/c1-2-19(22-23(27)20-7-4-8-21(20)31-24(22)28)16-5-3-6-17(13-16)26-32(29,30)18-11-9-15(14-25)10-12-18/h3,5-6,9-13,19-22,26H,2,4,7-8H2,1H3
PDB
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UniProtKB/SwissProt

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 0.147n/an/an/an/an/an/an/an/a



Pharmacia and Upjohn

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards HIV protease was determined

J Med Chem 39: 4125-30 (1996)


Article DOI: 10.1021/jm960296c
BindingDB Entry DOI: 10.7270/Q2KH0MFB
More data for this
Ligand-Target Pair