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PubMed code 18304810

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50372897
PNG
(CHEMBL402911)
Show SMILES CCOC(=O)C(N)c1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1cccs1 |w:5.5|
Show InChI InChI=1S/C21H21N3O3S/c1-2-27-21(26)19(23)13-5-7-14(8-6-13)20(25)24-17-12-15(9-10-16(17)22)18-4-3-11-28-18/h3-12,19H,2,22-23H2,1H3,(H,24,25)
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PC cid
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Article
PubMed
n/an/a 5.70E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human ERG

Bioorg Med Chem Lett 18: 1859-63 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.012
BindingDB Entry DOI: 10.7270/Q2G73FKH
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))		BDBM50372896
PNG
(CHEMBL258132)
Show SMILES CN(C)C(=O)C(N)c1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1cccs1 |w:5.5|
Show InChI InChI=1S/C21H22N4O2S/c1-25(2)21(27)19(23)13-5-7-14(8-6-13)20(26)24-17-12-15(9-10-16(17)22)18-4-3-11-28-18/h3-12,19H,22-23H2,1-2H3,(H,24,26)
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UniChem

Similars
Article
PubMed
n/an/a 6.80E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human ERG

Bioorg Med Chem Lett 18: 1859-63 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.012
BindingDB Entry DOI: 10.7270/Q2G73FKH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%