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BDBM50157768 5-(4-(2-methoxyphenyl)piperazin-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide::CHEMBL222864

SMILES: COc1ccccc1N1CCN(CCCCC(=O)NC2CCCc3ccccc23)CC1

InChI Key: InChIKey=COFRSTRKYJRGFB-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50157768   
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
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50157768
PNG
(5-(4-(2-methoxyphenyl)piperazin-1-yl)-N-(1,2,3,4-t...)
Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NC2CCCc3ccccc23)CC1
Show InChI InChI=1S/C26H35N3O2/c1-31-25-14-5-4-13-24(25)29-19-17-28(18-20-29)16-7-6-15-26(30)27-23-12-8-10-21-9-2-3-11-22(21)23/h2-5,9,11,13-14,23H,6-8,10,12,15-20H2,1H3,(H,27,30)
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KEGG

UniProtKB/SwissProt

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CHEMBL
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PC sid
UniChem

Similars

Article
PubMed
6.05n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from rat recombinant 5HT7 receptor expressed in HEK293 cells


J Med Chem 47: 6616-24 (2004)


Article DOI: 10.1021/jm049702f
BindingDB Entry DOI: 10.7270/Q2RX9BKX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50157768
PNG
(5-(4-(2-methoxyphenyl)piperazin-1-yl)-N-(1,2,3,4-t...)
Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NC2CCCc3ccccc23)CC1
Show InChI InChI=1S/C26H35N3O2/c1-31-25-14-5-4-13-24(25)29-19-17-28(18-20-29)16-7-6-15-26(30)27-23-12-8-10-21-9-2-3-11-22(21)23/h2-5,9,11,13-14,23H,6-8,10,12,15-20H2,1H3,(H,27,30)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.10n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor transfected in CFO-K1 cells after 30 mins by liquid scintillation spectrometry


Eur J Med Chem 85: 716-26 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.023
BindingDB Entry DOI: 10.7270/Q2DZ09Z8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50157768
PNG
(5-(4-(2-methoxyphenyl)piperazin-1-yl)-N-(1,2,3,4-t...)
Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NC2CCCc3ccccc23)CC1
Show InChI InChI=1S/C26H35N3O2/c1-31-25-14-5-4-13-24(25)29-19-17-28(18-20-29)16-7-6-15-26(30)27-23-12-8-10-21-9-2-3-11-22(21)23/h2-5,9,11,13-14,23H,6-8,10,12,15-20H2,1H3,(H,27,30)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9n/an/an/an/an/an/an/an/a



Universit£ di Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]5-HT from human 5HT7 receptor transfected in CFO-K1 cells after 30 mins by liquid scintillation spectrometry


Eur J Med Chem 85: 716-26 (2014)


Article DOI: 10.1016/j.ejmech.2014.08.023
BindingDB Entry DOI: 10.7270/Q2DZ09Z8
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50157768
PNG
(5-(4-(2-methoxyphenyl)piperazin-1-yl)-N-(1,2,3,4-t...)
Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NC2CCCc3ccccc23)CC1
Show InChI InChI=1S/C26H35N3O2/c1-31-25-14-5-4-13-24(25)29-19-17-28(18-20-29)16-7-6-15-26(30)27-23-12-8-10-21-9-2-3-11-22(21)23/h2-5,9,11,13-14,23H,6-8,10,12,15-20H2,1H3,(H,27,30)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]8-OH-DPAT from 5HT1A receptor in Wistar Han rat hippocampal membranes


J Med Chem 47: 6616-24 (2004)


Article DOI: 10.1021/jm049702f
BindingDB Entry DOI: 10.7270/Q2RX9BKX
More data for this
Ligand-Target Pair