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BDBM50306817 CHEMBL600606::N-(Cyclopropylmethyl)-N-(3-(4-(4-fluorophenyl)piperazin-1-yl)propyl)naphthalene-2-sulfonamide

SMILES: Fc1ccc(cc1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1

InChI Key: InChIKey=VVTDHDJLGYYTGA-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50306817   
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))
BDBM50306817
PNG
(CHEMBL600606 | N-(Cyclopropylmethyl)-N-(3-(4-(4-fl...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H32FN3O2S/c28-25-9-11-26(12-10-25)30-18-16-29(17-19-30)14-3-15-31(21-22-6-7-22)34(32,33)27-13-8-23-4-1-2-5-24(23)20-27/h1-2,4-5,8-13,20,22H,3,6-7,14-19,21H2
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 51n/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 (5-HT7)


(Homo sapiens (human))
BDBM50306817
PNG
(CHEMBL600606 | N-(Cyclopropylmethyl)-N-(3-(4-(4-fl...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H32FN3O2S/c28-25-9-11-26(12-10-25)30-18-16-29(17-19-30)14-3-15-31(21-22-6-7-22)34(32,33)27-13-8-23-4-1-2-5-24(23)20-27/h1-2,4-5,8-13,20,22H,3,6-7,14-19,21H2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 49.6n/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 (5-HT2C)


(Homo sapiens (human))
BDBM50306817
PNG
(CHEMBL600606 | N-(Cyclopropylmethyl)-N-(3-(4-(4-fl...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCN(CC2CC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C27H32FN3O2S/c28-25-9-11-26(12-10-25)30-18-16-29(17-19-30)14-3-15-31(21-22-6-7-22)34(32,33)27-13-8-23-4-1-2-5-24(23)20-27/h1-2,4-5,8-13,20,22H,3,6-7,14-19,21H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 343n/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