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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 = 'BDBM50150087'   
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


(Homo sapiens (Human))
BDBM50150087
PNG
(CHEMBL435612 | [2-(5-Fluoro-2,3-dihydro-benzofuran...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cc(F)cc4CCOc34)c2c1
Show InChI InChI=1S/C20H20F2N2O2/c21-15-1-2-18-17(10-15)14(12-24-18)3-5-23-6-8-25-19-11-16(22)9-13-4-7-26-20(13)19/h1-2,9-12,23-24H,3-8H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
35.1n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50150087
PNG
(CHEMBL435612 | [2-(5-Fluoro-2,3-dihydro-benzofuran...)
Show SMILES Fc1ccc2[nH]cc(CCNCCOc3cc(F)cc4CCOc34)c2c1
Show InChI InChI=1S/C20H20F2N2O2/c21-15-1-2-18-17(10-15)14(12-24-18)3-5-23-6-8-25-19-11-16(22)9-13-4-7-26-20(13)19/h1-2,9-12,23-24H,3-8H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 138n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition concentration against binding of radioligand [35]GTPgammaS in CHO cells expressing 5-hydroxytryptamine 1A receptor


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair