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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrase' and Ligand = 'BDBM50482818'   
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
Integrase


(Human immunodeficiency virus 1)		BDBM50482818
PNG
(CHEMBL1257823)
Show SMILES Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1nnc(Cc2ccc(F)cc2)s1
Show InChI InChI=1S/C21H18FN5O3S/c22-14-3-1-13(2-4-14)11-17-24-25-20(31-17)18-19(28)21(29)27-12-15(5-6-16(27)23-18)26-7-9-30-10-8-26/h1-6,12,28H,7-11H2
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 225n/an/an/an/an/an/a



Avexa Ltd

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 integrase-mediated 3'-processing and strand transfer activity

Bioorg Med Chem Lett 20: 5909-12 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.081
BindingDB Entry DOI: 10.7270/Q2XW4NNV
More data for this
Ligand-Target Pair