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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50249219   
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
ATP-sensitive inward rectifier potassium channel 1


(Homo sapiens (Human))
BDBM50249219
PNG
(CHEMBL4076563)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2cnsn2)CC1 |r|
Show InChI InChI=1S/C21H24N4O4S/c1-13-14(2-3-15-16(13)12-29-19(15)27)17(26)11-24-7-4-21(5-8-24)6-9-25(20(21)28)18-10-22-30-23-18/h2-3,10,17,26H,4-9,11-12H2,1H3/t17-/m0/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 47n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Inhibition of human ROMK channel expressed in HEK293 cells after 30 mins by FLIPR based thallium flux assay


Bioorg Med Chem Lett 27: 2559-2566 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.086
BindingDB Entry DOI: 10.7270/Q2BV7K1G
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50249219
PNG
(CHEMBL4076563)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2cnsn2)CC1 |r|
Show InChI InChI=1S/C21H24N4O4S/c1-13-14(2-3-15-16(13)12-29-19(15)27)17(26)11-24-7-4-21(5-8-24)6-9-25(20(21)28)18-10-22-30-23-18/h2-3,10,17,26H,4-9,11-12H2,1H3/t17-/m0/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.10E+3n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Displacement of [35S]MK499 from human ERG expressed in HEK293 cells


Bioorg Med Chem Lett 27: 2559-2566 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.086
BindingDB Entry DOI: 10.7270/Q2BV7K1G
More data for this
Ligand-Target Pair