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BDBM50289547 1-Phenethyl-3-((E)-styryl)-piperidine::CHEMBL287937

SMILES: C(Cc1ccccc1)N1CCCC(C1)\C=C\c1ccccc1

InChI Key: InChIKey=YKCREYMJRACNJN-BUHFOSPRSA-N

Data: 3 IC50

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 3 hits for monomerid = 50289547   
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
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50289547
PNG
(1-Phenethyl-3-((E)-styryl)-piperidine | CHEMBL2879...)
Show SMILES C(Cc1ccccc1)N1CCCC(C1)\C=C\c1ccccc1
Show InChI InChI=1S/C21H25N/c1-3-8-19(9-4-1)13-14-21-12-7-16-22(18-21)17-15-20-10-5-2-6-11-20/h1-6,8-11,13-14,21H,7,12,15-18H2/b14-13+
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity at sigma receptor by [3H]-(+)-SKF-10,047 displacement.


Bioorg Med Chem Lett 7: 1525-1530 (1997)


Article DOI: 10.1016/S0960-894X(97)00253-9
BindingDB Entry DOI: 10.7270/Q2N58MCN
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50289547
PNG
(1-Phenethyl-3-((E)-styryl)-piperidine | CHEMBL2879...)
Show SMILES C(Cc1ccccc1)N1CCCC(C1)\C=C\c1ccccc1
Show InChI InChI=1S/C21H25N/c1-3-8-19(9-4-1)13-14-21-12-7-16-22(18-21)17-15-20-10-5-2-6-11-20/h1-6,8-11,13-14,21H,7,12,15-18H2/b14-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity at dopamine D1 receptor in rat striatum by [3H]-SCH-22,390 displacement.


Bioorg Med Chem Lett 7: 1525-1530 (1997)


Article DOI: 10.1016/S0960-894X(97)00253-9
BindingDB Entry DOI: 10.7270/Q2N58MCN
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50289547
PNG
(1-Phenethyl-3-((E)-styryl)-piperidine | CHEMBL2879...)
Show SMILES C(Cc1ccccc1)N1CCCC(C1)\C=C\c1ccccc1
Show InChI InChI=1S/C21H25N/c1-3-8-19(9-4-1)13-14-21-12-7-16-22(18-21)17-15-20-10-5-2-6-11-20/h1-6,8-11,13-14,21H,7,12,15-18H2/b14-13+
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 2.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity at dopamine D2 receptor in rat striatum by [3H]-Spiperone displacement.


Bioorg Med Chem Lett 7: 1525-1530 (1997)


Article DOI: 10.1016/S0960-894X(97)00253-9
BindingDB Entry DOI: 10.7270/Q2N58MCN
More data for this
Ligand-Target Pair