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BDBM50308176 1-[3-(2-Naphthylsulfonyl)-1H-indazol-5-yl]piperidin-4-amine::CHEMBL603483

SMILES: NC1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=OYOYEIIOGFLVQY-UHFFFAOYSA-N

Data: 2 KI  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 3 hits for monomerid = 50308176   
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 6


(Homo sapiens (Human))
BDBM50308176
PNG
(1-[3-(2-Naphthylsulfonyl)-1H-indazol-5-yl]piperidi...)
Show SMILES NC1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H22N4O2S/c23-17-9-11-26(12-10-17)18-6-8-21-20(14-18)22(25-24-21)29(27,28)19-7-5-15-3-1-2-4-16(15)13-19/h1-8,13-14,17H,9-12,23H2,(H,24,25)
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
18.2n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human 5HT6 receptor by scintillation counting


J Med Chem 53: 2521-7 (2010)


Article DOI: 10.1021/jm901674f
BindingDB Entry DOI: 10.7270/Q22B8Z43
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50308176
PNG
(1-[3-(2-Naphthylsulfonyl)-1H-indazol-5-yl]piperidi...)
Show SMILES NC1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H22N4O2S/c23-17-9-11-26(12-10-17)18-6-8-21-20(14-18)22(25-24-21)29(27,28)19-7-5-15-3-1-2-4-16(15)13-19/h1-8,13-14,17H,9-12,23H2,(H,24,25)
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antibodypedia
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PC cid
PC sid
UniChem

Similars

Article
PubMed
1.36E+3n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]5HT from human 5HT2B receptor expressed in CHO cells by scintillation counting


J Med Chem 53: 2521-7 (2010)


Article DOI: 10.1021/jm901674f
BindingDB Entry DOI: 10.7270/Q22B8Z43
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50308176
PNG
(1-[3-(2-Naphthylsulfonyl)-1H-indazol-5-yl]piperidi...)
Show SMILES NC1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H22N4O2S/c23-17-9-11-26(12-10-17)18-6-8-21-20(14-18)22(25-24-21)29(27,28)19-7-5-15-3-1-2-4-16(15)13-19/h1-8,13-14,17H,9-12,23H2,(H,24,25)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 88.9n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned 5HT6 receptor expressed in human HeLa cells assessed as intracellular cAMP formation by RIA


J Med Chem 53: 2521-7 (2010)


Article DOI: 10.1021/jm901674f
BindingDB Entry DOI: 10.7270/Q22B8Z43
More data for this
Ligand-Target Pair