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BDBM50306822 CHEMBL603092::N-(4-(4-Phenylpiperazin-1-yl)butan-2-yl)naphthalene-2-sulfonamide

SMILES: CC(CCN1CCN(CC1)c1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=MFBRVGWZBCQSSV-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50306822   
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
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50306822
PNG
(CHEMBL603092 | N-(4-(4-Phenylpiperazin-1-yl)butan-...)
Show SMILES CC(CCN1CCN(CC1)c1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H29N3O2S/c1-20(13-14-26-15-17-27(18-16-26)23-9-3-2-4-10-23)25-30(28,29)24-12-11-21-7-5-6-8-22(21)19-24/h2-12,19-20,25H,13-18H2,1H3
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/a 12.7n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from human recombinant 5HT2A receptor expressed in avCHO-K1 cells


Bioorg Med Chem 18: 1665-75 (2010)


Article DOI: 10.1016/j.bmc.2009.12.067
BindingDB Entry DOI: 10.7270/Q2R78F99
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50306822
PNG
(CHEMBL603092 | N-(4-(4-Phenylpiperazin-1-yl)butan-...)
Show SMILES CC(CCN1CCN(CC1)c1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H29N3O2S/c1-20(13-14-26-15-17-27(18-16-26)23-9-3-2-4-10-23)25-30(28,29)24-12-11-21-7-5-6-8-22(21)19-24/h2-12,19-20,25H,13-18H2,1H3
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Article
PubMed
n/an/a 657n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


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


Bioorg Med Chem 18: 1665-75 (2010)


Article DOI: 10.1016/j.bmc.2009.12.067
BindingDB Entry DOI: 10.7270/Q2R78F99
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50306822
PNG
(CHEMBL603092 | N-(4-(4-Phenylpiperazin-1-yl)butan-...)
Show SMILES CC(CCN1CCN(CC1)c1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C24H29N3O2S/c1-20(13-14-26-15-17-27(18-16-26)23-9-3-2-4-10-23)25-30(28,29)24-12-11-21-7-5-6-8-22(21)19-24/h2-12,19-20,25H,13-18H2,1H3
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PC sid
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Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from human recombinant 5HT2C receptor expressed in CHO-K1 cells


Bioorg Med Chem 18: 1665-75 (2010)


Article DOI: 10.1016/j.bmc.2009.12.067
BindingDB Entry DOI: 10.7270/Q2R78F99
More data for this
Ligand-Target Pair