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BDBM50251648 CHEMBL479952::N-(6-(pyridin-3-yloxy)pyridin-3-yl)-1H-indole-3-carboxamide

SMILES: O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12

InChI Key: InChIKey=BVEOZKOLIKNPKQ-UHFFFAOYSA-N

Data: 8 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 8 hits for monomerid = 50251648   
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))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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n/an/a 1.60n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine at human cloned 5HT2C receptor expressed in CHOK1 cell


Bioorg Med Chem Lett 18: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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PubMed
n/an/a>1.00E+4n/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: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
Dopamine receptor


(Homo sapiens (Human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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n/an/a>1.00E+4n/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: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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n/an/a>1.00E+4n/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: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 7 (5-HT7)


(Homo sapiens (human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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n/an/a>1.00E+4n/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: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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n/an/a>1.00E+4n/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


Bioorg Med Chem Lett 18: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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n/an/a>1.00E+3n/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: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50251648
PNG
(CHEMBL479952 | N-(6-(pyridin-3-yloxy)pyridin-3-yl)...)
Show SMILES O=C(Nc1ccc(Oc2cccnc2)nc1)c1c[nH]c2ccccc12
Show InChI InChI=1S/C19H14N4O2/c24-19(16-12-21-17-6-2-1-5-15(16)17)23-13-7-8-18(22-10-13)25-14-4-3-9-20-11-14/h1-12,21H,(H,23,24)
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PubMed
n/an/a>1.00E+4n/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: 3844-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.064
BindingDB Entry DOI: 10.7270/Q2P84BQN
More data for this
Ligand-Target Pair