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BDBM50000081 CHEMBL358109::[2-(4-Chloro-phenyl)-ethyl]-methyl-(2-pyrrolidin-1-yl-ethyl)-amine

SMILES: CN(CCN1CCCC1)CCc1ccc(Cl)cc1

InChI Key: InChIKey=GHXKIAKUHUUOBY-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50000081   
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))
BDBM50000081
PNG
(CHEMBL358109 | [2-(4-Chloro-phenyl)-ethyl]-methyl-...)
Show SMILES CN(CCN1CCCC1)CCc1ccc(Cl)cc1
Show InChI InChI=1S/C15H23ClN2/c1-17(12-13-18-9-2-3-10-18)11-8-14-4-6-15(16)7-5-14/h4-7H,2-3,8-13H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
1.5n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+) -3PPP from sigma receptor in guinea pig brain membranes


J Med Chem 35: 38-47 (1992)


BindingDB Entry DOI: 10.7270/Q2BP01RW
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50000081
PNG
(CHEMBL358109 | [2-(4-Chloro-phenyl)-ethyl]-methyl-...)
Show SMILES CN(CCN1CCCC1)CCc1ccc(Cl)cc1
Show InChI InChI=1S/C15H23ClN2/c1-17(12-13-18-9-2-3-10-18)11-8-14-4-6-15(16)7-5-14/h4-7H,2-3,8-13H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2.40n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity was evaluated against sigma-1 binding site in guinea pig,using [3H]- -(+)- Pentazocine


J Med Chem 36: 566-71 (1993)


BindingDB Entry DOI: 10.7270/Q2DV1KH3
More data for this
Ligand-Target Pair