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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50231656'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50231656
PNG
(CHEMBL283397 | TCMDC-132113)
Show SMILES CN1CCC(=CC1)c1c[nH]c2ccc(OCc3ccccc3)cc12 |c:4|
Show InChI InChI=1S/C21H22N2O/c1-23-11-9-17(10-12-23)20-14-22-21-8-7-18(13-19(20)21)24-15-16-5-3-2-4-6-16/h2-9,13-14,22H,10-12,15H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
111n/an/an/an/an/an/an/an/a



University of Georgia

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor using [3H]8-OH-DPAT as radioligand.


J Med Chem 36: 4006-14 (1993)


Article DOI: 10.1021/jm00077a003
BindingDB Entry DOI: 10.7270/Q2W37ZJ4
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50231656
PNG
(CHEMBL283397 | TCMDC-132113)
Show SMILES CN1CCC(=CC1)c1c[nH]c2ccc(OCc3ccccc3)cc12 |c:4|
Show InChI InChI=1S/C21H22N2O/c1-23-11-9-17(10-12-23)20-14-22-21-8-7-18(13-19(20)21)24-15-16-5-3-2-4-6-16/h2-9,13-14,22H,10-12,15H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
112n/an/an/an/an/an/an/an/a



Universit£ de Lausanne

Curated by ChEMBL


Assay Description
Binding affinity of a compound to rat brain 5-hydroxytryptamine 1A (serotonin) receptor assayed by radiolabeled [3H]-8-OH-DPAT ligand displacement


J Med Chem 39: 126-34 (1996)


Article DOI: 10.1021/jm950410b
BindingDB Entry DOI: 10.7270/Q2VX0K7V
More data for this
Ligand-Target Pair