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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-1B adrenergic receptor' and Ligand = 'BDBM50500016'   
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-1B adrenergic receptor


(Homo sapiens (Human))
BDBM50500016
PNG
(CHEMBL3740874)
Show SMILES Fc1cc(ccc1N1CCN(CCc2ccc(CN3C(=O)c4ccccc4C3=O)cc2)CC1)C#N
Show InChI InChI=1S/C28H25FN4O2/c29-25-17-22(18-30)9-10-26(25)32-15-13-31(14-16-32)12-11-20-5-7-21(8-6-20)19-33-27(34)23-3-1-2-4-24(23)28(33)35/h1-10,17H,11-16,19H2
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Jinan University

Curated by ChEMBL


Assay Description
Antagonist activity at adrenergic alpha1B receptor (unknown origin) by firefly and renilla dual glo luciferase assay


Bioorg Med Chem 23: 7735-42 (2015)


Article DOI: 10.1016/j.bmc.2015.11.020
BindingDB Entry DOI: 10.7270/Q2K0779G
More data for this
Ligand-Target Pair