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Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50415776   
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))
BDBM50415776
PNG
(CHEMBL1083182)
Show SMILES COc1ccccc1OCCNCC1CSC(O1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H27NO3S/c1-27-23-14-8-9-15-24(23)28-17-16-26-18-22-19-30-25(29-22,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-15,22,26H,16-19H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.02n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in human HeLa cells


Bioorg Med Chem Lett 20: 2017-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.030
BindingDB Entry DOI: 10.7270/Q2X34ZQJ
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50415776
PNG
(CHEMBL1083182)
Show SMILES COc1ccccc1OCCNCC1CSC(O1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H27NO3S/c1-27-23-14-8-9-15-24(23)28-17-16-26-18-22-19-30-25(29-22,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-15,22,26H,16-19H2,1H3
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KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
6.61n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from human Alpha-1D adrenergic receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 2017-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.030
BindingDB Entry DOI: 10.7270/Q2X34ZQJ
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50415776
PNG
(CHEMBL1083182)
Show SMILES COc1ccccc1OCCNCC1CSC(O1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H27NO3S/c1-27-23-14-8-9-15-24(23)28-17-16-26-18-22-19-30-25(29-22,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-15,22,26H,16-19H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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PC sid
UniChem
Article
PubMed
20.9n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from human alpha1A adrenergic receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 2017-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.030
BindingDB Entry DOI: 10.7270/Q2X34ZQJ
More data for this
Ligand-Target Pair
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM50415776
PNG
(CHEMBL1083182)
Show SMILES COc1ccccc1OCCNCC1CSC(O1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H27NO3S/c1-27-23-14-8-9-15-24(23)28-17-16-26-18-22-19-30-25(29-22,20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-15,22,26H,16-19H2,1H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
100n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosin from human Alpha-1B adrenergic receptor expressed in CHO cells


Bioorg Med Chem Lett 20: 2017-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.030
BindingDB Entry DOI: 10.7270/Q2X34ZQJ
More data for this
Ligand-Target Pair