BindingDB logo
myBDB logout

BDBM50324864 CHEMBL1221450::Naphthalene-2-sulfonic acid cyclopentylmethyl-[3-(4-methyl-piperazin-1-yl)-phenyl]-amide

SMILES: CN1CCN(CC1)c1cccc(c1)N(CC1CCCC1)S(=O)(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=SDPZJMZIVPDJDR-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50324864   
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 2C (5-HT2C)


(Homo sapiens (human))
BDBM50324864
PNG
(CHEMBL1221450 | Naphthalene-2-sulfonic acid cyclop...)
Show SMILES CN1CCN(CC1)c1cccc(c1)N(CC1CCCC1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C27H33N3O2S/c1-28-15-17-29(18-16-28)25-11-6-12-26(20-25)30(21-22-7-2-3-8-22)33(31,32)27-14-13-23-9-4-5-10-24(23)19-27/h4-6,9-14,19-20,22H,2-3,7-8,15-18,21H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 11n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from human 5HT2C expressed in CHOKI cells


Bioorg Med Chem Lett 20: 5221-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.150
BindingDB Entry DOI: 10.7270/Q27W6CCH
More data for this
Ligand-Target Pair