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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 = 'BDBM458967'   
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))
BDBM458967
PNG
(US10759794, Example 39)
Show SMILES CC(C)Oc1cccc(n1)C(=O)N1CCN(Cc2c(nc3ccccn23)-c2ccc(Cl)cc2)CC1
Show InChI InChI=1S/C27H28ClN5O2/c1-19(2)35-25-8-5-6-22(29-25)27(34)32-16-14-31(15-17-32)18-23-26(20-9-11-21(28)12-10-20)30-24-7-3-4-13-33(23)24/h3-13,19H,14-18H2,1-2H3
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 6.20n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The investigations on the inhibition of the recombinant TASK-1 and TASK-3 channels were carried out using stably transfected CHO cells. Here, the com...


US Patent US10759794 (2020)


BindingDB Entry DOI: 10.7270/Q2KK9FW6
More data for this
Ligand-Target Pair
Potassium channel subfamily K member 9


(Homo sapiens (Human))
BDBM458967
PNG
(US10759794, Example 39)
Show SMILES CC(C)Oc1cccc(n1)C(=O)N1CCN(Cc2c(nc3ccccn23)-c2ccc(Cl)cc2)CC1
Show InChI InChI=1S/C27H28ClN5O2/c1-19(2)35-25-8-5-6-22(29-25)27(34)32-16-14-31(15-17-32)18-23-26(20-9-11-21(28)12-10-20)30-24-7-3-4-13-33(23)24/h3-13,19H,14-18H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 56n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
The investigations on the inhibition of the recombinant TASK-1 and TASK-3 channels were carried out using stably transfected CHO cells. Here, the com...


US Patent US10759794 (2020)


BindingDB Entry DOI: 10.7270/Q2KK9FW6
More data for this
Ligand-Target Pair