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BDBM50228648 5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline-2,4(1H,3H)-dione::CHEMBL404352

SMILES: CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1

InChI Key: InChIKey=MUALJDCOWOWPTA-UHFFFAOYNA-N

Data: 9 KI

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 9 hits for monomerid = 50228648   
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 (5-HT6)


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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Article
PubMed
30.1n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human cloned 5HT6 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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Article
PubMed
1.81E+3n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH-23390 from human cloned dopamine D1 receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from human cloned 5HT2A receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D3 receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D2 receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 7 (5-HT7)


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human cloned 5HT7 receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human cloned dopamine D4 receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from human cloned 5HT2C receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50228648
PNG
(5,7-dichloro-3-(3-hydroxyphenyl)-3-methylquinoline...)
Show SMILES CC1(C(=O)Nc2cc(Cl)cc(Cl)c2C1=O)c1cccc(O)c1
Show InChI InChI=1/C16H11Cl2NO3/c1-16(8-3-2-4-10(20)5-8)14(21)13-11(18)6-9(17)7-12(13)19-15(16)22/h2-7,20H,1H3,(H,19,22)
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human cloned 5HT1A receptor


Bioorg Med Chem Lett 18: 738-43 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.045
BindingDB Entry DOI: 10.7270/Q2XK8F99
More data for this
Ligand-Target Pair