Found 4 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50427202
(CHEMBL2324511)Show SMILES Fc1cn(-[#6]-[#6@H]-2-[#6]-[#7](-[#6](=O)-[#8]-2)-c2ccc(-[#7]-3-[#6]-[#6]\[#6](-[#6]-[#6]-3)=[#6]/C#N)c(F)c2)nn1 |r| Show InChI InChI=1S/C19H18F2N6O2/c20-16-9-14(1-2-17(16)25-7-4-13(3-6-22)5-8-25)27-11-15(29-19(27)28)10-26-12-18(21)23-24-26/h1-3,9,12,15H,4-5,7-8,10-11H2/t15-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.37E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Institute Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG by automated patch clamp assay |
Bioorg Med Chem Lett 23: 1193-6 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.033
BindingDB Entry DOI: 10.7270/Q2N017V0 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50427200
(CHEMBL2324520)Show SMILES [#6]\[#6](C#N)=[#6]-1\[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccc(cc1F)-[#7]-1-[#6]-[#6@H](-[#6]-n2cc(F)nn2)-[#8]-[#6]-1=O |r| Show InChI InChI=1S/C20H20F2N6O2/c1-13(9-23)14-4-6-26(7-5-14)18-3-2-15(8-17(18)21)28-11-16(30-20(28)29)10-27-12-19(22)24-25-27/h2-3,8,12,16H,4-7,10-11H2,1H3/t16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Institute Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG by automated patch clamp assay |
Bioorg Med Chem Lett 23: 1193-6 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.033
BindingDB Entry DOI: 10.7270/Q2N017V0 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50427203
(CHEMBL2324510)Show SMILES Fc1cc(ccc1-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]/C#N)-[#7]-1-[#6]-[#6@H](-[#6]-n2ccnn2)-[#8]-[#6]-1=O |r| Show InChI InChI=1S/C19H19FN6O2/c20-17-11-15(1-2-18(17)24-8-4-14(3-6-21)5-9-24)26-13-16(28-19(26)27)12-25-10-7-22-23-25/h1-3,7,10-11,16H,4-5,8-9,12-13H2/t16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Institute Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG by automated patch clamp assay |
Bioorg Med Chem Lett 23: 1193-6 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.033
BindingDB Entry DOI: 10.7270/Q2N017V0 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50427201
(CHEMBL2324519)Show SMILES [#6]\[#6](C#N)=[#6]-1\[#6]-[#6]-[#7](-[#6]-[#6]-1)-c1ccc(cc1F)-[#7]-1-[#6]-[#6@H](-[#6]-n2ccnn2)-[#8]-[#6]-1=O |r| Show InChI InChI=1S/C20H21FN6O2/c1-14(11-22)15-4-7-25(8-5-15)19-3-2-16(10-18(19)21)27-13-17(29-20(27)28)12-26-9-6-23-24-26/h2-3,6,9-10,17H,4-5,7-8,12-13H2,1H3/t17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Institute Science and Technology
Curated by ChEMBL
| Assay Description
Inhibition of human hERG by automated patch clamp assay |
Bioorg Med Chem Lett 23: 1193-6 (2013)
Article DOI: 10.1016/j.bmcl.2013.01.033
BindingDB Entry DOI: 10.7270/Q2N017V0 |
More data for this
Ligand-Target Pair | |
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