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BDBM50235273 CHEMBL4084347

SMILES: OC(Cc1cccnc1-c1cccc(c1)C(F)(F)F)(c1cccnc1F)c1cccnc1F

InChI Key: InChIKey=ITQAKSHSWVNJKB-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50235273   
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
Voltage-gated potassium channel


(Homo sapiens (Human))
BDBM50235273
PNG
(CHEMBL4084347)
Show SMILES OC(Cc1cccnc1-c1cccc(c1)C(F)(F)F)(c1cccnc1F)c1cccnc1F
Show InChI InChI=1S/C24H16F5N3O/c25-21-18(8-3-11-31-21)23(33,19-9-4-12-32-22(19)26)14-16-6-2-10-30-20(16)15-5-1-7-17(13-15)24(27,28)29/h1-13,33H,14H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 195n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5 (unknown origin)


Bioorg Med Chem Lett 27: 1062-1069 (2017)


Article DOI: 10.1016/j.bmcl.2016.12.054
BindingDB Entry DOI: 10.7270/Q2DV1N5F
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50235273
PNG
(CHEMBL4084347)
Show SMILES OC(Cc1cccnc1-c1cccc(c1)C(F)(F)F)(c1cccnc1F)c1cccnc1F
Show InChI InChI=1S/C24H16F5N3O/c25-21-18(8-3-11-31-21)23(33,19-9-4-12-32-22(19)26)14-16-6-2-10-30-20(16)15-5-1-7-17(13-15)24(27,28)29/h1-13,33H,14H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-MK499 from human ERG IKr channel expressed in HEK293 cell membranes


Bioorg Med Chem Lett 27: 1062-1069 (2017)


Article DOI: 10.1016/j.bmcl.2016.12.054
BindingDB Entry DOI: 10.7270/Q2DV1N5F
More data for this
Ligand-Target Pair