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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 = 'BDBM50150100'   
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))
BDBM50150100
PNG
(CHEMBL340301 | [2-(1H-Indol-4-yloxy)-ethyl]-[3-(1H...)
Show SMILES C(CNCCOc1cccc2[nH]ccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C21H23N3O/c1-2-7-19-17(6-1)16(15-24-19)5-4-11-22-13-14-25-21-9-3-8-20-18(21)10-12-23-20/h1-3,6-10,12,15,22-24H,4-5,11,13-14H2
PDB

UniProtKB/SwissProt

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PC sid
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Similars

Article
PubMed
2.5n/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))
BDBM50150100
PNG
(CHEMBL340301 | [2-(1H-Indol-4-yloxy)-ethyl]-[3-(1H...)
Show SMILES C(CNCCOc1cccc2[nH]ccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C21H23N3O/c1-2-7-19-17(6-1)16(15-24-19)5-4-11-22-13-14-25-21-9-3-8-20-18(21)10-12-23-20/h1-3,6-10,12,15,22-24H,4-5,11,13-14H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 4n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Effective concentration against binding of radioligand [35]GTPgammaS in CHO cells expressing human 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