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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Potassium channel subfamily K member 9' and Ligand = 'BDBM413516'   
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 channel subfamily K member 9


(Homo sapiens (Human))
BDBM413516
PNG
(US10414765, Example 25)
Show SMILES COc1cccc(n1)C(=O)N1CC2CN(Cc3c(nc4ccccn34)-c3ccc(cc3)C(C)C)CC2C1
Show InChI InChI=1S/C30H33N5O2/c1-20(2)21-10-12-22(13-11-21)29-26(35-14-5-4-8-27(35)32-29)19-33-15-23-17-34(18-24(23)16-33)30(36)25-7-6-9-28(31-25)37-3/h4-14,20,23-24H,15-19H2,1-3H3
PDB

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n/an/a 44.1n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
In Vitro Electrophysiological Analysis of the Human TASK-1 and TASK-3 Channels Via Two-Electrode Voltage Clamp Technique in Xenopus laevis OocytesSub...


US Patent US10414765 (2019)


BindingDB Entry DOI: 10.7270/Q2QJ7KNV
More data for this
Ligand-Target Pair
Potassium channel subfamily K member 9


(Homo sapiens (Human))
BDBM413516
PNG
(US10414765, Example 25)
Show SMILES COc1cccc(n1)C(=O)N1CC2CN(Cc3c(nc4ccccn34)-c3ccc(cc3)C(C)C)CC2C1
Show InChI InChI=1S/C30H33N5O2/c1-20(2)21-10-12-22(13-11-21)29-26(35-14-5-4-8-27(35)32-29)19-33-15-23-17-34(18-24(23)16-33)30(36)25-7-6-9-28(31-25)37-3/h4-14,20,23-24H,15-19H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
UniChem
US Patent
n/an/a 410n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
In Vitro Electrophysiological Analysis of the Human TASK-1 and TASK-3 Channels Via Two-Electrode Voltage Clamp Technique in Xenopus laevis OocytesSub...


US Patent US10414765 (2019)


BindingDB Entry DOI: 10.7270/Q2QJ7KNV
More data for this
Ligand-Target Pair