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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1A' and Ligand = 'BDBM50036459'   
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))
BDBM50036459
PNG
(1-((3aR,9bS)-3-Propyl-2,3,3a,4,5,9b-hexahydro-1H-b...)
Show SMILES CCCN1CC[C@@H]2[C@H]1CCc1cccc(C(=O)CCC)c21
Show InChI InChI=1S/C19H27NO/c1-3-6-18(21)16-8-5-7-14-9-10-17-15(19(14)16)11-13-20(17)12-4-2/h5,7-8,15,17H,3-4,6,9-13H2,1-2H3/t15-,17-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
0.700n/an/an/an/an/an/an/an/a



Upjohn Laboratories

Curated by ChEMBL


Assay Description
In vitro displacement of radioactively labeled ligand [3H]-8-OH-DPAT from 5-hydroxytryptamine 1A receptor site in CHO cells


J Med Chem 38: 725-34 (1995)


BindingDB Entry DOI: 10.7270/Q20Z72B7
More data for this
Ligand-Target Pair