BindingDB logo
myBDB logout

BDBM50444870 CHEMBL3099485

SMILES: Oc1ccc(CN[C@H]2CC[C@@H](Cc3ccccc3)OC2)cc1

InChI Key: InChIKey=LKOFLYSQAVPDDB-HKUYNNGSSA-N

Data: 1 KI

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 = 50444870   
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
Transporter


(Rattus norvegicus (rat))
BDBM50444870
PNG
(CHEMBL3099485)
Show SMILES Oc1ccc(CN[C@H]2CC[C@@H](Cc3ccccc3)OC2)cc1 |r|
Show InChI InChI=1S/C19H23NO2/c21-18-9-6-16(7-10-18)13-20-17-8-11-19(22-14-17)12-15-4-2-1-3-5-15/h1-7,9-10,17,19-21H,8,11-14H2/t17-,19-/m0/s1
Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
240n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]-dopamine from rat cerebral cortex NET after 7 mins


Bioorg Med Chem 22: 311-24 (2013)


Article DOI: 10.1016/j.bmc.2013.11.017
BindingDB Entry DOI: 10.7270/Q2FB54D1
More data for this
Ligand-Target Pair