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BDBM50283327 1-Cyclopropylmethyl-4-[2-(3-phenyl-prop-2-ynyloxy)-ethyl]-piperidine::CHEMBL75678

SMILES: C(CC1CCN(CC2CC2)CC1)OCC#Cc1ccccc1

InChI Key: InChIKey=WMBHBWPQFUUUCP-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50283327   
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


(Homo sapiens (Human))
BDBM50283327
PNG
(1-Cyclopropylmethyl-4-[2-(3-phenyl-prop-2-ynyloxy)...)
Show SMILES C(CC1CCN(CC2CC2)CC1)OCC#Cc1ccccc1
Show InChI InChI=1S/C20H27NO/c1-2-5-18(6-3-1)7-4-15-22-16-12-19-10-13-21(14-11-19)17-20-8-9-20/h1-3,5-6,19-20H,8-17H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
1n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity towards sigma receptor using [3H]-(+)-SKF-10,047 as radioligand


Bioorg Med Chem Lett 4: 2347-2352 (1994)


Article DOI: 10.1016/0960-894X(94)85038-0
BindingDB Entry DOI: 10.7270/Q2S75G8F
More data for this
Ligand-Target Pair
Serotonin 2 (5-HT2) receptor


(Homo sapiens (Human))
BDBM50283327
PNG
(1-Cyclopropylmethyl-4-[2-(3-phenyl-prop-2-ynyloxy)...)
Show SMILES C(CC1CCN(CC2CC2)CC1)OCC#Cc1ccccc1
Show InChI InChI=1S/C20H27NO/c1-2-5-18(6-3-1)7-4-15-22-16-12-19-10-13-21(14-11-19)17-20-8-9-20/h1-3,5-6,19-20H,8-17H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
947n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity towards 5-HT2 receptor using [3H]ketanserin as radioligand


Bioorg Med Chem Lett 4: 2347-2352 (1994)


Article DOI: 10.1016/0960-894X(94)85038-0
BindingDB Entry DOI: 10.7270/Q2S75G8F
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50283327
PNG
(1-Cyclopropylmethyl-4-[2-(3-phenyl-prop-2-ynyloxy)...)
Show SMILES C(CC1CCN(CC2CC2)CC1)OCC#Cc1ccccc1
Show InChI InChI=1S/C20H27NO/c1-2-5-18(6-3-1)7-4-15-22-16-12-19-10-13-21(14-11-19)17-20-8-9-20/h1-3,5-6,19-20H,8-17H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
>1.00E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 using [3H]-spiperone as radioligand


Bioorg Med Chem Lett 4: 2347-2352 (1994)


Article DOI: 10.1016/0960-894X(94)85038-0
BindingDB Entry DOI: 10.7270/Q2S75G8F
More data for this
Ligand-Target Pair