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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1D adrenergic receptor' and Ligand = 'BDBM50456842'   
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
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50456842
PNG
(CHEMBL4210106)
Show SMILES Cl.CC(NCCOc1cc(F)ccc1Cl)c1ccccc1S(C)(=O)=O
Show InChI InChI=1S/C17H19ClFNO3S.ClH/c1-12(14-5-3-4-6-17(14)24(2,21)22)20-9-10-23-16-11-13(19)7-8-15(16)18;/h3-8,11-12,20H,9-10H2,1-2H3;1H
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PC cid
PC sid
UniChem
Article
PubMed
>94n/an/an/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

Curated by ChEMBL


Assay Description
Displacement of 7-methoxy-[3H]-prazosin from human alpha1D-adrenoreceptor expressed in CHOK1 cell membranes after 60 mins by TopCount liquid scintill...


Eur J Med Chem 139: 114-127 (2017)


Article DOI: 10.1016/j.ejmech.2017.07.071
BindingDB Entry DOI: 10.7270/Q2765HZH
More data for this
Ligand-Target Pair