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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Alpha-1B adrenergic receptor' and Ligand = 'BDBM50103891'   
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))
BDBM50103891
PNG
(CHEMBL3343980)
Show SMILES Cc1ccc2nccc(NCCCCCCCNc3ccnc4ccc(C)cc34)c2c1
Show InChI InChI=1S/C27H32N4/c1-20-8-10-24-22(18-20)26(12-16-30-24)28-14-6-4-3-5-7-15-29-27-13-17-31-25-11-9-21(2)19-23(25)27/h8-13,16-19H,3-7,14-15H2,1-2H3,(H,28,30)(H,29,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
151n/an/an/an/an/an/an/an/a



25288493

Curated by ChEMBL


Assay Description
Displacement of [3H]-prazosin from human alpha1B adrenergic receptor transfected in COS1 cells


Bioorg Med Chem 22: 5910-6 (2014)


Article DOI: 10.1016/j.bmc.2014.09.017
BindingDB Entry DOI: 10.7270/Q2NS0WP5
More data for this
Ligand-Target Pair
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM50103891
PNG
(CHEMBL3343980)
Show SMILES Cc1ccc2nccc(NCCCCCCCNc3ccnc4ccc(C)cc34)c2c1
Show InChI InChI=1S/C27H32N4/c1-20-8-10-24-22(18-20)26(12-16-30-24)28-14-6-4-3-5-7-15-29-27-13-17-31-25-11-9-21(2)19-23(25)27/h8-13,16-19H,3-7,14-15H2,1-2H3,(H,28,30)(H,29,31)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
151n/an/an/an/an/an/an/an/a



25288493

Curated by ChEMBL


Assay Description
Binding affinity to human alpha1B adrenergic receptor transfected in COS1 cells assessed as compound required to occupy 50% of receptor


Bioorg Med Chem 22: 5910-6 (2014)


Article DOI: 10.1016/j.bmc.2014.09.017
BindingDB Entry DOI: 10.7270/Q2NS0WP5
More data for this
Ligand-Target Pair