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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1A adrenergic receptor' and Ligand = 'BDBM50487268'   
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-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50487268
PNG
(CHEMBL2261353)
Show SMILES COc1ccc2C(CCCc2c1NS(C)(=O)=O)C1=NCCN1 |t:19|
Show InChI InChI=1S/C15H21N3O3S/c1-21-13-7-6-10-11(14(13)18-22(2,19)20)4-3-5-12(10)15-16-8-9-17-15/h6-7,12,18H,3-5,8-9H2,1-2H3,(H,16,17)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
617n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to alpha1A adrenoreceptor in Rattus norvegicus (rat) submaxillary gland by radioligand displacement assay


Citation and Details

Article DOI: 10.1007/s00044-004-0020-z
BindingDB Entry DOI: 10.7270/Q2PZ5CQB
More data for this
Ligand-Target Pair