Found 4 hits Enz. Inhib. hit(s) with Target = 'Potassium voltage-gated channel subfamily H member 2' and Ligand = 'BDBM50366823' 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)) | BDBM50366823
(Anzemet CINV | DOLASETRON)Show SMILES O=C(OC1C[C@H]2CC3C[C@H](C1)N2CC3=O)c1c[nH]c2ccccc12 |r,wU:5.12,9.11,TLB:14:13:6.5:9.8,(4.69,-2.6,;3.35,-1.83,;2.02,-2.61,;.69,-1.83,;-.65,-2.59,;-1.98,-1.82,;-3.3,-2.59,;-4.63,-1.82,;-.65,-1.05,;-.64,.49,;.69,-.29,;-1.97,-.28,;-3.32,.49,;-4.63,-.28,;-5.97,.49,;3.35,-.29,;2.46,.96,;3.37,2.19,;4.83,1.71,;6.16,2.47,;7.49,1.7,;7.49,.15,;6.15,-.61,;4.82,.16,)| Show InChI InChI=1S/C19H20N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,20H,5-8,10H2/t11?,12-,13-,14?/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 5.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bologna
Curated by ChEMBL
| Assay Description K+ channel blocking activity in human embryonic kidney cells expressing HERG Kv11.1 |
J Med Chem 45: 3844-53 (2002)
BindingDB Entry DOI: 10.7270/Q2NC61X3 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50366823
(Anzemet CINV | DOLASETRON)Show SMILES O=C(OC1C[C@H]2CC3C[C@H](C1)N2CC3=O)c1c[nH]c2ccccc12 |r,wU:5.12,9.11,TLB:14:13:6.5:9.8,(4.69,-2.6,;3.35,-1.83,;2.02,-2.61,;.69,-1.83,;-.65,-2.59,;-1.98,-1.82,;-3.3,-2.59,;-4.63,-1.82,;-.65,-1.05,;-.64,.49,;.69,-.29,;-1.97,-.28,;-3.32,.49,;-4.63,-.28,;-5.97,.49,;3.35,-.29,;2.46,.96,;3.37,2.19,;4.83,1.71,;6.16,2.47,;7.49,1.7,;7.49,.15,;6.15,-.61,;4.82,.16,)| Show InChI InChI=1S/C19H20N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,20H,5-8,10H2/t11?,12-,13-,14?/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
CASMedChem Laboratory
Curated by ChEMBL
| Assay Description Inhibition of human ERG in MCF7 cells |
Eur J Med Chem 44: 1926-32 (2009)
Article DOI: 10.1016/j.ejmech.2008.11.009 BindingDB Entry DOI: 10.7270/Q2TM7CCD |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50366823
(Anzemet CINV | DOLASETRON)Show SMILES O=C(OC1C[C@H]2CC3C[C@H](C1)N2CC3=O)c1c[nH]c2ccccc12 |r,wU:5.12,9.11,TLB:14:13:6.5:9.8,(4.69,-2.6,;3.35,-1.83,;2.02,-2.61,;.69,-1.83,;-.65,-2.59,;-1.98,-1.82,;-3.3,-2.59,;-4.63,-1.82,;-.65,-1.05,;-.64,.49,;.69,-.29,;-1.97,-.28,;-3.32,.49,;-4.63,-.28,;-5.97,.49,;3.35,-.29,;2.46,.96,;3.37,2.19,;4.83,1.71,;6.16,2.47,;7.49,1.7,;7.49,.15,;6.15,-.61,;4.82,.16,)| Show InChI InChI=1S/C19H20N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,20H,5-8,10H2/t11?,12-,13-,14?/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Hoffmann-La Roche
Curated by ChEMBL
| Assay Description Inhibition of human ERG expressed in CHO cells by whole cell patch clamp technique |
Bioorg Med Chem 16: 6252-60 (2008)
Article DOI: 10.1016/j.bmc.2008.04.028 BindingDB Entry DOI: 10.7270/Q25D8T25 |
More data for this Ligand-Target Pair | |
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human)) | BDBM50366823
(Anzemet CINV | DOLASETRON)Show SMILES O=C(OC1C[C@H]2CC3C[C@H](C1)N2CC3=O)c1c[nH]c2ccccc12 |r,wU:5.12,9.11,TLB:14:13:6.5:9.8,(4.69,-2.6,;3.35,-1.83,;2.02,-2.61,;.69,-1.83,;-.65,-2.59,;-1.98,-1.82,;-3.3,-2.59,;-4.63,-1.82,;-.65,-1.05,;-.64,.49,;.69,-.29,;-1.97,-.28,;-3.32,.49,;-4.63,-.28,;-5.97,.49,;3.35,-.29,;2.46,.96,;3.37,2.19,;4.83,1.71,;6.16,2.47,;7.49,1.7,;7.49,.15,;6.15,-.61,;4.82,.16,)| Show InChI InChI=1S/C19H20N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,9,11-14,20H,5-8,10H2/t11?,12-,13-,14?/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Reverse proteomics research institute
Curated by ChEMBL
| Assay Description Inhibitory concentration against potassium channel HERG |
Bioorg Med Chem Lett 15: 2886-90 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.080 BindingDB Entry DOI: 10.7270/Q29S1S7C |
More data for this Ligand-Target Pair | |