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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 = 'BDBM50473675'   
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))
BDBM50473675
PNG
(CHEMBL74114)
Show SMILES CS(=O)(=O)c1cccc(F)c1NCC1=NCCN1 |t:14|
Show InChI InChI=1S/C11H14FN3O2S/c1-18(16,17)9-4-2-3-8(12)11(9)15-7-10-13-5-6-14-10/h2-4,15H,5-7H2,1H3,(H,13,14)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
380n/an/an/an/an/an/an/an/a



GlaxoSmithKline Research Laboratories

Curated by ChEMBL


Assay Description
Affinity to human Alpha-1B adrenergic receptor determined by radioligand binding techniques from rat-1 fibroblasts membranes


J Med Chem 45: 2229-39 (2002)


Article DOI: 10.1021/jm000542r
BindingDB Entry DOI: 10.7270/Q2NG4TCQ
More data for this
Ligand-Target Pair
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM50473675
PNG
(CHEMBL74114)
Show SMILES CS(=O)(=O)c1cccc(F)c1NCC1=NCCN1 |t:14|
Show InChI InChI=1S/C11H14FN3O2S/c1-18(16,17)9-4-2-3-8(12)11(9)15-7-10-13-5-6-14-10/h2-4,15H,5-7H2,1H3,(H,13,14)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a<1.00E+5n/an/an/an/a



GlaxoSmithKline Research Laboratories

Curated by ChEMBL


Assay Description
Agonist potency at Alpha-1B adrenergic receptor expressed in rat-1 fibroblasts


J Med Chem 45: 2229-39 (2002)


Article DOI: 10.1021/jm000542r
BindingDB Entry DOI: 10.7270/Q2NG4TCQ
More data for this
Ligand-Target Pair