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PubMed code 2824774

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50405507
PNG
(CHEMBL70193)
Show SMILES CCC[n+]1cccc2C3CCCC(O)C3CCc12
Show InChI InChI=1S/C16H24NO/c1-2-10-17-11-4-6-13-12-5-3-7-16(18)14(12)8-9-15(13)17/h4,6,11-12,14,16,18H,2-3,5,7-10H2,1H3/q+1
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PC sid
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PubMed
n/an/a 360n/an/an/an/an/an/a



University of Lausanne

Curated by ChEMBL


Assay Description
Binding affinity against sigma receptor


J Med Chem 30: 2175-81 (1988)


BindingDB Entry DOI: 10.7270/Q2FF3TJC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50405506
PNG
(CHEMBL69826)
Show SMILES OC1CCC2CCc3c(ccc[n+]3Cc3ccccc3)C2C1
Show InChI InChI=1S/C20H24NO/c22-17-10-8-16-9-11-20-18(19(16)13-17)7-4-12-21(20)14-15-5-2-1-3-6-15/h1-7,12,16-17,19,22H,8-11,13-14H2/q+1
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PubMed
n/an/a 1.10E+7n/an/an/an/an/an/a



University of Lausanne

Curated by ChEMBL


Assay Description
Binding affinity against sigma receptor


J Med Chem 30: 2175-81 (1988)


BindingDB Entry DOI: 10.7270/Q2FF3TJC
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50405506
PNG
(CHEMBL69826)
Show SMILES OC1CCC2CCc3c(ccc[n+]3Cc3ccccc3)C2C1
Show InChI InChI=1S/C20H24NO/c22-17-10-8-16-9-11-20-18(19(16)13-17)7-4-12-21(20)14-15-5-2-1-3-6-15/h1-7,12,16-17,19,22H,8-11,13-14H2/q+1
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UniChem

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PubMed
n/an/a 2.88E+8n/an/an/an/an/an/a



University of Lausanne

Curated by ChEMBL


Assay Description
Binding affinity for dopamine receptor D2 was evaluated by the ability to displace [3H]spiperone


J Med Chem 30: 2175-81 (1988)


BindingDB Entry DOI: 10.7270/Q2FF3TJC
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%