BindingDB logo
myBDB logout

null

SMILES: CN1C2CCC1[C@@H](\C=C\CO)[C@H](C2)c1ccccc1

InChI Key: InChIKey=BAROFIYZXNPKFU-FECFIIMKSA-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 = 50472996   
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 dopamine transporter


(Rattus norvegicus (rat))
BDBM50472996
PNG
(CHEMBL134214)
Show SMILES CN1C2CCC1[C@@H](\C=C\CO)[C@H](C2)c1ccccc1 |TLB:7:6:1:4.3,THB:13:11:1:4.3|
Show InChI InChI=1S/C17H23NO/c1-18-14-9-10-17(18)15(8-5-11-19)16(12-14)13-6-3-2-4-7-13/h2-8,14-17,19H,9-12H2,1H3/b8-5+/t14?,15-,16+,17?/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
16n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse-Intramural Research Program

Curated by ChEMBL


Assay Description
Binding affinity to dopamine transporter (DAT) using [3H]WIN-35428 as a radioligand


J Med Chem 43: 4151-9 (2000)


Article DOI: 10.1021/jm990472s
BindingDB Entry DOI: 10.7270/Q2PK0JWZ
More data for this
Ligand-Target Pair