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2 similar compounds to monomer 50406158

Compile data set for download or QSAR
Wt: 322.4
BDBM50007413
Wt: 322.4
BDBM50406151

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50007413,50406151   
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))
BDBM50007413
PNG
(CHEMBL19351 | Phenyl-[4-(4-phenyl-butyl)-piperazin...)
Show SMILES O=C(N1CCN(CCCCc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c24-21(20-12-5-2-6-13-20)23-17-15-22(16-18-23)14-8-7-11-19-9-3-1-4-10-19/h1-6,9-10,12-13H,7-8,11,14-18H2
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Article
PubMed
125n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards sigma receptor in guinea pig brain membranes using [3H]-DTG as radioligand


J Med Chem 34: 3360-5 (1992)


Article DOI: 10.1021/jm00116a003
BindingDB Entry DOI: 10.7270/Q2MC8XZR
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50007413
PNG
(CHEMBL19351 | Phenyl-[4-(4-phenyl-butyl)-piperazin...)
Show SMILES O=C(N1CCN(CCCCc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c24-21(20-12-5-2-6-13-20)23-17-15-22(16-18-23)14-8-7-11-19-9-3-1-4-10-19/h1-6,9-10,12-13H,7-8,11,14-18H2
Reactome pathway
KEGG

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Article
PubMed
180n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2A receptor


J Med Chem 38: 1196-202 (1995)


Article DOI: 10.1021/jm00007a016
BindingDB Entry DOI: 10.7270/Q2CZ37TG
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50007413
PNG
(CHEMBL19351 | Phenyl-[4-(4-phenyl-butyl)-piperazin...)
Show SMILES O=C(N1CCN(CCCCc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c24-21(20-12-5-2-6-13-20)23-17-15-22(16-18-23)14-8-7-11-19-9-3-1-4-10-19/h1-6,9-10,12-13H,7-8,11,14-18H2
KEGG

UniProtKB/SwissProt

DrugBank
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PC sid
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Article
PubMed
8.52E+3n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2C receptor


J Med Chem 38: 1196-202 (1995)


Article DOI: 10.1021/jm00007a016
BindingDB Entry DOI: 10.7270/Q2CZ37TG
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50406151
PNG
(CHEMBL101388)
Show SMILES O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccccc1
Show InChI InChI=1S/C21H26N2O/c24-21(20-9-5-2-6-10-20)22-13-16-23-14-11-19(12-15-23)17-18-7-3-1-4-8-18/h1-10,19H,11-17H2,(H,22,24)
UniProtKB/SwissProt

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Article
PubMed
n/an/a 1.55E+3n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Antihistaminic activity against Histamine H1 receptor was measured on isolated terminal part of guinea pig ileum


J Med Chem 33: 2970-6 (1990)


Article DOI: 10.1021/jm00173a011
BindingDB Entry DOI: 10.7270/Q2Z89DMH
More data for this
Ligand-Target Pair