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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 = 'BDBM50290762'   
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))
BDBM50290762
PNG
(9-{4-[2-(2-Methoxy-phenoxy)-ethylamino]-butyryl}-3...)
Show SMILES COc1ccccc1OCCNCCCC(=O)N1CCCSc2c1cnn(C)c2=O
Show InChI InChI=1S/C21H28N4O4S/c1-24-21(27)20-16(15-23-24)25(12-6-14-30-20)19(26)9-5-10-22-11-13-29-18-8-4-3-7-17(18)28-2/h3-4,7-8,15,22H,5-6,9-14H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 9.20n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor using receptor binding assay


Bioorg Med Chem Lett 7: 2857-2862 (1997)


Article DOI: 10.1016/S0960-894X(97)10089-0
BindingDB Entry DOI: 10.7270/Q2NP24D6
More data for this
Ligand-Target Pair