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BDBM50056375 2-{3-[4-(2-Chloro-phenyl)-piperazin-1-yl]-propylsulfanyl}-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one::CHEMBL345628

SMILES: Cc1sc2nc(SCCCN3CCN(CC3)c3ccccc3Cl)[nH]c(=O)c2c1C

InChI Key: InChIKey=QHHGYNKBCBHEBR-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50056375   
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 1A


(Rattus norvegicus (rat))
BDBM50056375
PNG
(2-{3-[4-(2-Chloro-phenyl)-piperazin-1-yl]-propylsu...)
Show SMILES Cc1sc2nc(SCCCN3CCN(CC3)c3ccccc3Cl)[nH]c(=O)c2c1C
Show InChI InChI=1S/C21H25ClN4OS2/c1-14-15(2)29-20-18(14)19(27)23-21(24-20)28-13-5-8-25-9-11-26(12-10-25)17-7-4-3-6-16(17)22/h3-4,6-7H,5,8-13H2,1-2H3,(H,23,24,27)
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 460n/an/an/an/an/an/a



Università di Catania

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against radioligand [3H]-8-OH-DPAT binding to 5-hydroxytryptamine 1A receptor in rat hippocampal membrane.


J Med Chem 40: 574-85 (1997)


Article DOI: 10.1021/jm950866t
BindingDB Entry DOI: 10.7270/Q2K64H6C
More data for this
Ligand-Target Pair