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BDBM50166785 1-{2-[2-(4-Chloro-phenyl)-thiazol-4-ylmethoxy]-benzyl}-azocane::CHEMBL195180

SMILES: Clc1ccc(cc1)-c1nc(COc2ccccc2CN2CCCCCCC2)cs1

InChI Key: InChIKey=AWBXIUCLPYICQI-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 = 50166785   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50166785
PNG
(1-{2-[2-(4-Chloro-phenyl)-thiazol-4-ylmethoxy]-ben...)
Show SMILES Clc1ccc(cc1)-c1nc(COc2ccccc2CN2CCCCCCC2)cs1
Show InChI InChI=1S/C24H27ClN2OS/c25-21-12-10-19(11-13-21)24-26-22(18-29-24)17-28-23-9-5-4-8-20(23)16-27-14-6-2-1-3-7-15-27/h4-5,8-13,18H,1-3,6-7,14-17H2
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 30n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against displacement of 35[S] MK-499 binding to hERG channel expressed in HEK293 cells


Bioorg Med Chem Lett 15: 2943-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.093
BindingDB Entry DOI: 10.7270/Q2X929TB
More data for this
Ligand-Target Pair
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM50166785
PNG
(1-{2-[2-(4-Chloro-phenyl)-thiazol-4-ylmethoxy]-ben...)
Show SMILES Clc1ccc(cc1)-c1nc(COc2ccccc2CN2CCCCCCC2)cs1
Show InChI InChI=1S/C24H27ClN2OS/c25-21-12-10-19(11-13-21)24-26-22(18-29-24)17-28-23-9-5-4-8-20(23)16-27-14-6-2-1-3-7-15-27/h4-5,8-13,18H,1-3,6-7,14-17H2
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against Na v1.7 channel expressed in HEK293 cells using Voltage/Ion Probe Reader (VIPR) assay


Bioorg Med Chem Lett 15: 2943-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.093
BindingDB Entry DOI: 10.7270/Q2X929TB
More data for this
Ligand-Target Pair