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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 = 'BDBM50474670'   
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


(HAMSTER)		BDBM50474670
PNG
(CHEMBL111584)
Show SMILES Cn1cnc(c1)C1CCCc2c(NS(C)(=O)=O)cccc12
Show InChI InChI=1S/C15H19N3O2S/c1-18-9-15(16-10-18)13-7-3-6-12-11(13)5-4-8-14(12)17-21(2,19)20/h4-5,8-10,13,17H,3,6-7H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
 1.05E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to Cricetinae (hamster) alpha1B adrenoreceptor 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
Alpha-1B adrenergic receptor


(HAMSTER)		BDBM50474670
PNG
(CHEMBL111584)
Show SMILES Cn1cnc(c1)C1CCCc2c(NS(C)(=O)=O)cccc12
Show InChI InChI=1S/C15H19N3O2S/c1-18-9-15(16-10-18)13-7-3-6-12-11(13)5-4-8-14(12)17-21(2,19)20/h4-5,8-10,13,17H,3,6-7H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 2.04E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity towards alpha-1B adrenergic receptor of hamster clone in radioligand binding assay

J Med Chem 47: 3220-35 (2004)


Article DOI: 10.1021/jm030551a
BindingDB Entry DOI: 10.7270/Q2HD7ZD1
More data for this
Ligand-Target Pair