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BDBM50044437 1-Phenyl-8-(4-phenyl-butyl)-1,3,8-triaza-spiro[4.5]decan-4-one::CHEMBL419848

SMILES: O=C1NCN(c2ccccc2)C11CCN(CCCCc2ccccc2)CC1

InChI Key: InChIKey=SPPBTNFMHDABPE-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50044437   
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 2 (5-HT2) receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50044437
PNG
(1-Phenyl-8-(4-phenyl-butyl)-1,3,8-triaza-spiro[4.5...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CCCCc2ccccc2)CC1
Show InChI InChI=1S/C23H29N3O/c27-22-23(26(19-24-22)21-12-5-2-6-13-21)14-17-25(18-15-23)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-19H2,(H,24,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
30n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Tested for binding affinity against 5-hydroxytryptamine 2 receptor from rat frontal cortical regions using [3H]ketanserin as radioligand


J Med Chem 36: 2519-25 (1993)


BindingDB Entry DOI: 10.7270/Q2QF8RZ9
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50044437
PNG
(1-Phenyl-8-(4-phenyl-butyl)-1,3,8-triaza-spiro[4.5...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CCCCc2ccccc2)CC1
Show InChI InChI=1S/C23H29N3O/c27-22-23(26(19-24-22)21-12-5-2-6-13-21)14-17-25(18-15-23)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-19H2,(H,24,27)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
85n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Tested for binding affinity against 5-hydroxytryptamine 1A receptor from rat frontal cortical regions using [3H]-8-OH-DPAT as radioligand


J Med Chem 36: 2519-25 (1993)


BindingDB Entry DOI: 10.7270/Q2QF8RZ9
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50044437
PNG
(1-Phenyl-8-(4-phenyl-butyl)-1,3,8-triaza-spiro[4.5...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CCCCc2ccccc2)CC1
Show InChI InChI=1S/C23H29N3O/c27-22-23(26(19-24-22)21-12-5-2-6-13-21)14-17-25(18-15-23)16-8-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13H,7-8,11,14-19H2,(H,24,27)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Tested for binding affinity against 5-hydroxytryptamine 1C receptor from rat frontal cortical regions using [3H]-mesulergine as radioligand


J Med Chem 36: 2519-25 (1993)


BindingDB Entry DOI: 10.7270/Q2QF8RZ9
More data for this
Ligand-Target Pair