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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calcium-activated potassium channel subunit alpha-1' and Ligand = 'BDBM50412335'   
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
Calcium-activated potassium channel subunit alpha-1


(Rattus norvegicus)
BDBM50412335
PNG
(CHEMBL498702)
Show SMILES COc1ccc(Br)cc1[C@@H](O)[C@H]1Sc2ccc(cc2NC1=O)C(F)(F)F |r|
Show InChI InChI=1S/C17H13BrF3NO3S/c1-25-12-4-3-9(18)7-10(12)14(23)15-16(24)22-11-6-8(17(19,20)21)2-5-13(11)26-15/h2-7,14-15,23H,1H3,(H,22,24)/t14-,15-/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.31E+3n/an/an/an/an/an/a



Universit£ degli Studi di Pisa

Curated by ChEMBL


Assay Description
Activation of large-conductance calcium-activated potassium channel-mediated vasorelaxation in endothelium-denuded normotensive Wistar rat thoracic a...


J Med Chem 51: 5085-92 (2008)


Article DOI: 10.1021/jm701605f
BindingDB Entry DOI: 10.7270/Q2R49S16
More data for this
Ligand-Target Pair