BindingDB logo
myBDB logout

BDBM50050452 CHEMBL3183945

SMILES: O=C(Nc1cccc(NC(=O)c2ccccc2)c1)c1ccsc1

InChI Key: InChIKey=CLQPBNWLFLJSSC-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 = 50050452   
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 channel subfamily K member 9


(Homo sapiens (Human))
BDBM50050452
PNG
(CHEMBL3183945)
Show SMILES O=C(Nc1cccc(NC(=O)c2ccccc2)c1)c1ccsc1
Show InChI InChI=1S/C18H14N2O2S/c21-17(13-5-2-1-3-6-13)19-15-7-4-8-16(11-15)20-18(22)14-9-10-23-12-14/h1-12H,(H,19,21)(H,20,22)
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 5.60E+3n/an/an/an/an/an/a



University of Kansas Specialized Chemistry Center

Curated by ChEMBL


Assay Description
Inhibition of TASK-3 (unknown origin) expressed in CHO cells by thallium flux assay


Bioorg Med Chem Lett 24: 3968-73 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.032
BindingDB Entry DOI: 10.7270/Q2805487
More data for this
Ligand-Target Pair
Potassium channel protein TASK-1


(Homo sapiens (Human))
BDBM50050452
PNG
(CHEMBL3183945)
Show SMILES O=C(Nc1cccc(NC(=O)c2ccccc2)c1)c1ccsc1
Show InChI InChI=1S/C18H14N2O2S/c21-17(13-5-2-1-3-6-13)19-15-7-4-8-16(11-15)20-18(22)14-9-10-23-12-14/h1-12H,(H,19,21)(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 160n/an/an/an/an/an/a



University of Kansas Specialized Chemistry Center

Curated by ChEMBL


Assay Description
Inhibition of TASK-1 (unknown origin) expressed in CHO cells by thallium flux assay


Bioorg Med Chem Lett 24: 3968-73 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.032
BindingDB Entry DOI: 10.7270/Q2805487
More data for this
Ligand-Target Pair