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2 similar compounds to monomer 50145029

Compile data set for download or QSAR
Wt: 364.5
BDBM50145017
Wt: 336.5
BDBM50145026

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50145017,50145026   
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))
BDBM50145026
PNG
(1-Cyclohexyl-4-(3-naphthalen-1-yl-propyl)-piperazi...)
Show SMILES C(CN1CCN(CC1)C1CCCCC1)Cc1cccc2ccccc12
Show InChI InChI=1S/C23H32N2/c1-2-12-22(13-3-1)25-18-16-24(17-19-25)15-7-11-21-10-6-9-20-8-4-5-14-23(20)21/h4-6,8-10,14,22H,1-3,7,11-13,15-19H2
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.16n/an/an/an/an/an/an/an/a



Università di Bari

Curated by ChEMBL


Assay Description
In vitro binding afinity at opioid sigma-1 receptorin guinea pig brain membranes by (+)-[3H]-pentazocine displacement.


J Med Chem 47: 2308-17 (2004)


Article DOI: 10.1021/jm031026e
BindingDB Entry DOI: 10.7270/Q2DN44HS
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50145017
PNG
(1-Cyclohexyl-4-(5-naphthalen-1-yl-pentyl)-piperazi...)
Show SMILES C(CCN1CCN(CC1)C1CCCCC1)CCc1cccc2ccccc12
Show InChI InChI=1S/C25H36N2/c1-4-14-24(15-5-1)27-20-18-26(19-21-27)17-8-2-3-10-22-12-9-13-23-11-6-7-16-25(22)23/h6-7,9,11-13,16,24H,1-5,8,10,14-15,17-21H2
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.40n/an/an/an/an/an/an/an/a



Università di Bari

Curated by ChEMBL


Assay Description
In vitro binding afinity at opioid sigma-1 receptorin guinea pig brain membranes by (+)-[3H]-pentazocine displacement.


J Med Chem 47: 2308-17 (2004)


Article DOI: 10.1021/jm031026e
BindingDB Entry DOI: 10.7270/Q2DN44HS
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50145017
PNG
(1-Cyclohexyl-4-(5-naphthalen-1-yl-pentyl)-piperazi...)
Show SMILES C(CCN1CCN(CC1)C1CCCCC1)CCc1cccc2ccccc12
Show InChI InChI=1S/C25H36N2/c1-4-14-24(15-5-1)27-20-18-26(19-21-27)17-8-2-3-10-22-12-9-13-23-11-6-7-16-25(22)23/h6-7,9,11-13,16,24H,1-5,8,10,14-15,17-21H2
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>700n/an/an/an/an/an/an/an/a



Università di Bari

Curated by ChEMBL


Assay Description
In vitro binding affinity at serotonin 5-hydroxytryptamine 3 receptor in rat cortex by [3H]-granisetron displacement.


J Med Chem 47: 2308-17 (2004)


Article DOI: 10.1021/jm031026e
BindingDB Entry DOI: 10.7270/Q2DN44HS
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50145026
PNG
(1-Cyclohexyl-4-(3-naphthalen-1-yl-propyl)-piperazi...)
Show SMILES C(CN1CCN(CC1)C1CCCCC1)Cc1cccc2ccccc12
Show InChI InChI=1S/C23H32N2/c1-2-12-22(13-3-1)25-18-16-24(17-19-25)15-7-11-21-10-6-9-20-8-4-5-14-23(20)21/h4-6,8-10,14,22H,1-3,7,11-13,15-19H2
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>700n/an/an/an/an/an/an/an/a



Università di Bari

Curated by ChEMBL


Assay Description
In vitro binding affinity at serotonin 5-hydroxytryptamine 3 receptor in rat cortex by [3H]-granisetron displacement.


J Med Chem 47: 2308-17 (2004)


Article DOI: 10.1021/jm031026e
BindingDB Entry DOI: 10.7270/Q2DN44HS
More data for this
Ligand-Target Pair