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SMILES: FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCC3)cc2)cc1

InChI Key: InChIKey=VNDJNTDOXJSQLX-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 = 50382861   
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
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50382861
PNG
(CHEMBL2024388)
Show SMILES FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCC3)cc2)cc1
Show InChI InChI=1S/C20H22F3N3O4S/c21-20(22,23)15-3-5-16(6-4-15)24-19(27)25-31(28,29)18-9-7-17(8-10-18)30-14-13-26-11-1-2-12-26/h3-10H,1-2,11-14H2,(H2,24,25,27)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.07E+5n/an/an/an/an/an/a



Universidad de Navarra

Curated by ChEMBL


Assay Description
Displacement of [125H]iodoproxyphan from human histamine H3 receptor expressed in CHO-K1 cells


Eur J Med Chem 52: 1-13 (2012)


Article DOI: 10.1016/j.ejmech.2012.02.049
BindingDB Entry DOI: 10.7270/Q2XS5WDZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50382861
PNG
(CHEMBL2024388)
Show SMILES FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCC3)cc2)cc1
Show InChI InChI=1S/C20H22F3N3O4S/c21-20(22,23)15-3-5-16(6-4-15)24-19(27)25-31(28,29)18-9-7-17(8-10-18)30-14-13-26-11-1-2-12-26/h3-10H,1-2,11-14H2,(H2,24,25,27)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universidad de Navarra

Curated by ChEMBL


Assay Description
Displacement of [3H] dofetilide from human ERG channel expressed in HEK293 cells after 45 mins by scintillation counting method


Eur J Med Chem 52: 1-13 (2012)


Article DOI: 10.1016/j.ejmech.2012.02.049
BindingDB Entry DOI: 10.7270/Q2XS5WDZ
More data for this
Ligand-Target Pair