BindingDB logo
myBDB logout

null

SMILES: O[C@@](Cc1ccccc1Br)([C@@H]1CNCCO1)c1ccccc1

InChI Key: InChIKey=IXXMPCPWTWLRBY-ZWKOTPCHSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50180523   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))		BDBM50180523
PNG
((R)-2-(2-bromophenyl)-1-((S)-morpholin-2-yl)-1-phe...)
Show SMILES O[C@@](Cc1ccccc1Br)([C@@H]1CNCCO1)c1ccccc1
Show InChI InChI=1S/C18H20BrNO2/c19-16-9-5-4-6-14(16)12-18(21,15-7-2-1-3-8-15)17-13-20-10-11-22-17/h1-9,17,20-21H,10-13H2/t17-,18+/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
 11.9n/an/an/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Binding affinity to NET

Bioorg Med Chem Lett 16: 2022-5 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.061
BindingDB Entry DOI: 10.7270/Q21J9BJ5
More data for this
Ligand-Target Pair