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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Alpha-2B adrenergic receptor' and Ligand = 'BDBM50511341'   
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-2B adrenergic receptor


(Homo sapiens (Human))		BDBM50511341
PNG
(CHEMBL4483761)
Show SMILES CCOc1cc(nnc1C(F)(F)F)N1CCC2(CC1)C(=O)Nc1ccc(Br)cc21
Show InChI InChI=1S/C19H18BrF3N4O2/c1-2-29-14-10-15(25-26-16(14)19(21,22)23)27-7-5-18(6-8-27)12-9-11(20)3-4-13(12)24-17(18)28/h3-4,9-10H,2,5-8H2,1H3,(H,24,28)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 790n/an/an/an/an/an/a



Division of Janssen-Cilag S.A.

Curated by ChEMBL


Assay Description
Displacement of [3H]RX 821002 from human recombinant adrenergic alpha-2B receptor expressed in CHO cells

ACS Med Chem Lett 11: 303-308 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00350
BindingDB Entry DOI: 10.7270/Q2GB27DF
More data for this
Ligand-Target Pair