PubMed code 22809456
Found 2 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)) | BDBM50395541
(CHEMBL2164761)Show SMILES CS(=O)(=O)c1ccc(cc1Cl)[C@@H](CC1CCCC1)C(=O)Nc1cnccn1 |r| Show InChI InChI=1S/C19H22ClN3O3S/c1-27(25,26)17-7-6-14(11-16(17)20)15(10-13-4-2-3-5-13)19(24)23-18-12-21-8-9-22-18/h6-9,11-13,15H,2-5,10H2,1H3,(H,22,23,24)/t15-/m1/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 | 7.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hoffmann-La Roche Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human ERG |
J Med Chem 55: 7021-36 (2012)
Article DOI: 10.1021/jm3008689
BindingDB Entry DOI: 10.7270/Q22B904W |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50395540
(CHEMBL2164443)Show SMILES CS(=O)(=O)c1ccc(cc1F)C(CC1CCCC1)C(=O)Nc1nccs1 Show InChI InChI=1S/C18H21FN2O3S2/c1-26(23,24)16-7-6-13(11-15(16)19)14(10-12-4-2-3-5-12)17(22)21-18-20-8-9-25-18/h6-9,11-12,14H,2-5,10H2,1H3,(H,20,21,22) | 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 | 2.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hoffmann-La Roche Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human ERG |
J Med Chem 55: 7021-36 (2012)
Article DOI: 10.1021/jm3008689
BindingDB Entry DOI: 10.7270/Q22B904W |
More data for this
Ligand-Target Pair | |
* indicates data uncertainty>20%
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