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SMILES: CC1(CC1)c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)n(n1)-c1ccccc1

InChI Key: InChIKey=LNTOZVGJRVNTIE-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50497416   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
G protein-activated inward rectifier potassium channel 4


(Homo sapiens (Human))
BDBM50497416
PNG
(CHEMBL3339118)
Show SMILES CC1(CC1)c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)n(n1)-c1ccccc1
Show InChI InChI=1S/C21H19F3N4O/c1-20(11-12-20)17-13-18(28(27-17)16-5-3-2-4-6-16)26-19(29)25-15-9-7-14(8-10-15)21(22,23)24/h2-10,13H,11-12H2,1H3,(H2,25,26,29)
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UniProtKB/SwissProt

DrugBank
antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 850n/an/an/an/an/an/a



Northwest A&F University

Curated by ChEMBL


Assay Description
Inhibition of GIRK1/4 (unknown origin) by thallium-flux based assay


Bioorg Med Chem Lett 24: 5102-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.061
BindingDB Entry DOI: 10.7270/Q2WD43JR
More data for this
Ligand-Target Pair
G protein-activated inward rectifier potassium channel 1


(Homo sapiens (Human))
BDBM50497416
PNG
(CHEMBL3339118)
Show SMILES CC1(CC1)c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)n(n1)-c1ccccc1
Show InChI InChI=1S/C21H19F3N4O/c1-20(11-12-20)17-13-18(28(27-17)16-5-3-2-4-6-16)26-19(29)25-15-9-7-14(8-10-15)21(22,23)24/h2-10,13H,11-12H2,1H3,(H2,25,26,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



Northwest A&F University

Curated by ChEMBL


Assay Description
Inhibition of GIRK1/2 (unknown origin) by thallium-flux based assay


Bioorg Med Chem Lett 24: 5102-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.061
BindingDB Entry DOI: 10.7270/Q2WD43JR
More data for this
Ligand-Target Pair