BindingDB logo
myBDB logout

Patent code US8552017

Compile Data Set for Download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM103506
PNG
(CHEMBL2172186 | US8552017, 1.1(3).HCl)
Show SMILES CNc1nn2c3CCN(C)Cc3cnc2c1S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19N5O2S/c1-18-16-15(25(23,24)13-6-4-3-5-7-13)17-19-10-12-11-21(2)9-8-14(12)22(17)20-16/h3-7,10H,8-9,11H2,1-2H3,(H,18,20)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Similars
US Patent
 0.389n/a 0.837n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The screening of the disclosed compounds for their potential ability to interact with serotonin 5-HT6 receptors was carried out b the method of radio...

US Patent US8552017 (2013)


BindingDB Entry DOI: 10.7270/Q2R49PDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM103505
PNG
(CHEMBL2172193 | US8552017, 2(4).HCl)
Show SMILES CNc1nn2c(C)c3CN(C)CCc3nc2c1S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H21N5O2S/c1-12-14-11-22(3)10-9-15(14)20-18-16(17(19-2)21-23(12)18)26(24,25)13-7-5-4-6-8-13/h4-8H,9-11H2,1-3H3,(H,19,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
US Patent
 0.662n/a 1.43n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The screening of the disclosed compounds for their potential ability to interact with serotonin 5-HT6 receptors was carried out b the method of radio...

US Patent US8552017 (2013)


BindingDB Entry DOI: 10.7270/Q2R49PDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM103507
PNG
(CHEMBL2172187 | US8552017, 1.1(4).HCl)
Show SMILES CNc1nn2c3CCN(C)Cc3c(C)nc2c1S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H21N5O2S/c1-12-14-11-22(3)10-9-15(14)23-18(20-12)16(17(19-2)21-23)26(24,25)13-7-5-4-6-8-13/h4-8H,9-11H2,1-3H3,(H,19,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
US Patent
 0.685n/a 1.48n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The screening of the disclosed compounds for their potential ability to interact with serotonin 5-HT6 receptors was carried out b the method of radio...

US Patent US8552017 (2013)


BindingDB Entry DOI: 10.7270/Q2R49PDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM103504
PNG
(CHEMBL2172192 | US8552017, 2(7).HCl)
Show SMILES CNc1nn2cc3CN(C)CCc3nc2c1S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C17H19N5O2S/c1-18-16-15(25(23,24)13-6-4-3-5-7-13)17-19-14-8-9-21(2)10-12(14)11-22(17)20-16/h3-7,11H,8-10H2,1-2H3,(H,18,20)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars
US Patent
 3.26n/a 7.02n/an/an/an/an/an/a



TBA

US Patent


Assay Description
The screening of the disclosed compounds for their potential ability to interact with serotonin 5-HT6 receptors was carried out b the method of radio...

US Patent US8552017 (2013)


BindingDB Entry DOI: 10.7270/Q2R49PDW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%