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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Potassium voltage-gated channel subfamily H member 2' and Ligand = 'BDBM50193846'   
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))
BDBM50193846
PNG
(1-({4-[4-chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)...)
Show SMILES CCOC(=O)C1CCCN(C1)C(=N)c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C28H27Cl2N5O4/c1-2-39-28(38)19-4-3-13-35(16-19)25(31)17-5-7-18(8-6-17)26(36)33-23-11-9-20(29)14-22(23)27(37)34-24-12-10-21(30)15-32-24/h5-12,14-15,19,31H,2-4,13,16H2,1H3,(H,33,36)(H,32,34,37)
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16n/an/an/an/an/an/an/an/a



Amgen San Francisco

Curated by ChEMBL


Assay Description
Binding affinity to human Erg


Bioorg Med Chem Lett 22: 3781-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.006
BindingDB Entry DOI: 10.7270/Q2542PMN
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50193846
PNG
(1-({4-[4-chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)...)
Show SMILES CCOC(=O)C1CCCN(C1)C(=N)c1ccc(cc1)C(=O)Nc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C28H27Cl2N5O4/c1-2-39-28(38)19-4-3-13-35(16-19)25(31)17-5-7-18(8-6-17)26(36)33-23-11-9-20(29)14-22(23)27(37)34-24-12-10-21(30)15-32-24/h5-12,14-15,19,31H,2-4,13,16H2,1H3,(H,33,36)(H,32,34,37)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
16n/an/an/an/an/an/an/an/a



Portola Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG potassium channel expressed in HEK293 cells


Bioorg Med Chem Lett 16: 5507-12 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.039
BindingDB Entry DOI: 10.7270/Q2SF2X05
More data for this
Ligand-Target Pair