Found 6 hits Enz. Inhib. hit(s) with all data for entry = 50040276 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)) | BDBM50391834
(CHEMBL2147024)Show SMILES Cc1cc(ccc1-c1ccnc(NCc2cc(n[nH]2)-c2ccccn2)c1)C#N Show InChI InChI=1S/C22H18N6/c1-15-10-16(13-23)5-6-19(15)17-7-9-25-22(11-17)26-14-18-12-21(28-27-18)20-4-2-3-8-24-20/h2-12H,14H2,1H3,(H,25,26)(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human ERG channel IKr expressed in CHO cells by patch clamp assay |
ACS Med Chem Lett 3: 678-682 (2012)
Article DOI: 10.1021/ml300146q
BindingDB Entry DOI: 10.7270/Q23J3F11 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50391830
(CHEMBL2147020)Show SMILES Cc1cc(ccc1-c1ccnc(NCc2n[nH]c3ncccc23)c1)C#N Show InChI InChI=1S/C20H16N6/c1-13-9-14(11-21)4-5-16(13)15-6-8-22-19(10-15)24-12-18-17-3-2-7-23-20(17)26-25-18/h2-10H,12H2,1H3,(H,22,24)(H,23,25,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human ERG channel IKr expressed in CHO cells by patch clamp assay |
ACS Med Chem Lett 3: 678-682 (2012)
Article DOI: 10.1021/ml300146q
BindingDB Entry DOI: 10.7270/Q23J3F11 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50391831
(CHEMBL2147021)Show SMILES Cc1cc(ccc1-c1ccnc(NCc2n[nH]c3nc(F)ccc23)c1)C#N Show InChI InChI=1S/C20H15FN6/c1-12-8-13(10-22)2-3-15(12)14-6-7-23-19(9-14)24-11-17-16-4-5-18(21)25-20(16)27-26-17/h2-9H,11H2,1H3,(H,23,24)(H,25,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human ERG channel IKr expressed in CHO cells by patch clamp assay |
ACS Med Chem Lett 3: 678-682 (2012)
Article DOI: 10.1021/ml300146q
BindingDB Entry DOI: 10.7270/Q23J3F11 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50391832
(CHEMBL2147022)Show SMILES Cc1cc(ccc1-c1ccnc(NCc2n[nH]c3nc(N)ccc23)c1)C#N Show InChI InChI=1S/C20H17N7/c1-12-8-13(10-21)2-3-15(12)14-6-7-23-19(9-14)24-11-17-16-4-5-18(22)25-20(16)27-26-17/h2-9H,11H2,1H3,(H,23,24)(H3,22,25,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human ERG channel IKr expressed in CHO cells by patch clamp assay |
ACS Med Chem Lett 3: 678-682 (2012)
Article DOI: 10.1021/ml300146q
BindingDB Entry DOI: 10.7270/Q23J3F11 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50391835
(CHEMBL2147025)Show SMILES Cc1cc(ccc1-c1ccnc(NCc2[nH]nc(c2Cl)-c2ccccn2)c1)C#N Show InChI InChI=1S/C22H17ClN6/c1-14-10-15(12-24)5-6-17(14)16-7-9-26-20(11-16)27-13-19-21(23)22(29-28-19)18-4-2-3-8-25-18/h2-11H,13H2,1H3,(H,26,27)(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human ERG channel IKr expressed in CHO cells by patch clamp assay |
ACS Med Chem Lett 3: 678-682 (2012)
Article DOI: 10.1021/ml300146q
BindingDB Entry DOI: 10.7270/Q23J3F11 |
More data for this
Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50391833
(CHEMBL2147023)Show SMILES Cc1cc(ccc1-c1ccnc(NCc2[nH]nc(c2Cl)-c2ccccc2)c1)C#N Show InChI InChI=1S/C23H18ClN5/c1-15-11-16(13-25)7-8-19(15)18-9-10-26-21(12-18)27-14-20-22(24)23(29-28-20)17-5-3-2-4-6-17/h2-12H,14H2,1H3,(H,26,27)(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human ERG channel IKr expressed in CHO cells by patch clamp assay |
ACS Med Chem Lett 3: 678-682 (2012)
Article DOI: 10.1021/ml300146q
BindingDB Entry DOI: 10.7270/Q23J3F11 |
More data for this
Ligand-Target Pair | |
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