BindingDB logo
myBDB logout

BDBM50307488 2-(6-(2,6-Dimethylphenyl)pyridin-2-ylthio)-N,Ndimethylethanamine::CHEMBL597357

SMILES: CN(C)CCSc1cccc(n1)-c1c(C)cccc1C

InChI Key: InChIKey=CCRVVFQJXRBXDH-UHFFFAOYSA-N

Data: 2 KI

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 = 50307488   
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
5-Hydroxytryptamine receptor 7 (5-HT7)


(Homo sapiens (Human))
BDBM50307488
PNG
(2-(6-(2,6-Dimethylphenyl)pyridin-2-ylthio)-N,Ndime...)
Show SMILES CN(C)CCSc1cccc(n1)-c1c(C)cccc1C
Show InChI InChI=1S/C17H22N2S/c1-13-7-5-8-14(2)17(13)15-9-6-10-16(18-15)20-12-11-19(3)4/h5-10H,11-12H2,1-4H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
128n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Displacement of [3H]5CT from human cloned 5HT7B receptor expressed in HEK293 cells


Bioorg Med Chem 18: 1958-67 (2010)


Article DOI: 10.1016/j.bmc.2010.01.035
BindingDB Entry DOI: 10.7270/Q2S182M1
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50307488
PNG
(2-(6-(2,6-Dimethylphenyl)pyridin-2-ylthio)-N,Ndime...)
Show SMILES CN(C)CCSc1cccc(n1)-c1c(C)cccc1C
Show InChI InChI=1S/C17H22N2S/c1-13-7-5-8-14(2)17(13)15-9-6-10-16(18-15)20-12-11-19(3)4/h5-10H,11-12H2,1-4H3
KEGG

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
927n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat hippocampus


Bioorg Med Chem 18: 1958-67 (2010)


Article DOI: 10.1016/j.bmc.2010.01.035
BindingDB Entry DOI: 10.7270/Q2S182M1
More data for this
Ligand-Target Pair