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Compile Data Set for Download or QSAR

Found 13 hits Enz. Inhib. hit(s) with Target = 'Melatonin receptor 1C'   
Target
(Institution)
LigandTarget
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
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423058
PNG
(CHEMBL244471)
Show SMILES O=C(NCCc1cn2CCCc3cccc1c23)C1CC1
Show InChI InChI=1S/C17H20N2O/c20-17(13-6-7-13)18-9-8-14-11-19-10-2-4-12-3-1-5-15(14)16(12)19/h1,3,5,11,13H,2,4,6-10H2,(H,18,20)
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n/an/a 282n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423056
PNG
(CHEMBL243002)
Show SMILES CC(=O)NCC1(CCCCC1)c1cn2CCCc3cccc1c23
Show InChI InChI=1S/C20H26N2O/c1-15(23)21-14-20(10-3-2-4-11-20)18-13-22-12-6-8-16-7-5-9-17(18)19(16)22/h5,7,9,13H,2-4,6,8,10-12,14H2,1H3,(H,21,23)
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n/an/a 1.18E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423059
PNG
(CHEMBL244472)
Show SMILES CCCC(=O)NCCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C18H24N2O/c1-2-6-17(21)19-11-4-8-15-13-20-12-5-9-14-7-3-10-16(15)18(14)20/h3,7,10,13H,2,4-6,8-9,11-12H2,1H3,(H,19,21)
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n/an/a 1.41E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423057
PNG
(CHEMBL242573)
Show SMILES O=C(NCCCc1cn2CCCc3cccc1c23)C1CC1
Show InChI InChI=1S/C18H22N2O/c21-18(14-8-9-14)19-10-2-5-15-12-20-11-3-6-13-4-1-7-16(15)17(13)20/h1,4,7,12,14H,2-3,5-6,8-11H2,(H,19,21)
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n/an/a 1.51E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423062
PNG
(CHEMBL242786)
Show SMILES O=C(NCCCc1cn2CCCc3cccc1c23)C1CCC1
Show InChI InChI=1S/C19H24N2O/c22-19(15-6-1-7-15)20-11-3-8-16-13-21-12-4-9-14-5-2-10-17(16)18(14)21/h2,5,10,13,15H,1,3-4,6-9,11-12H2,(H,20,22)
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n/an/a 1.59E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423063
PNG
(CHEMBL396501)
Show SMILES CCCC(=O)NCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C17H22N2O/c1-2-5-16(20)18-10-9-14-12-19-11-4-7-13-6-3-8-15(14)17(13)19/h3,6,8,12H,2,4-5,7,9-11H2,1H3,(H,18,20)
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n/an/a 1.70E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423061
PNG
(CHEMBL243003)
Show SMILES CCCC(=O)NCC1(CCCCC1)c1cn2CCCc3cccc1c23
Show InChI InChI=1S/C22H30N2O/c1-2-8-20(25)23-16-22(12-4-3-5-13-22)19-15-24-14-7-10-17-9-6-11-18(19)21(17)24/h6,9,11,15H,2-5,7-8,10,12-14,16H2,1H3,(H,23,25)
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n/an/a 2.04E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423055
PNG
(CHEMBL244957)
Show SMILES CCC(=O)NCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C16H20N2O/c1-2-15(19)17-9-8-13-11-18-10-4-6-12-5-3-7-14(13)16(12)18/h3,5,7,11H,2,4,6,8-10H2,1H3,(H,17,19)
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n/an/a 2.19E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM85065
PNG
(CAS_117946-91-5 | Luzindole | NSC_122162)
Show SMILES CC(=O)NCCc1c(Cc2ccccc2)[nH]c2ccccc12
Show InChI InChI=1S/C19H20N2O/c1-14(22)20-12-11-17-16-9-5-6-10-18(16)21-19(17)13-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)
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n/an/a 2.46E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423064
PNG
(CHEMBL244263)
Show SMILES CCC(=O)NCCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C17H22N2O/c1-2-16(20)18-10-4-7-14-12-19-11-5-8-13-6-3-9-15(14)17(13)19/h3,6,9,12H,2,4-5,7-8,10-11H2,1H3,(H,18,20)
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n/an/a 4.68E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423060
PNG
(CHEMBL241928)
Show SMILES CC(=O)NCCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C16H20N2O/c1-12(19)17-9-3-6-14-11-18-10-4-7-13-5-2-8-15(14)16(13)18/h2,5,8,11H,3-4,6-7,9-10H2,1H3,(H,17,19)
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PubMed
n/an/a 5.13E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50423065
PNG
(CHEMBL242806)
Show SMILES CC(=O)NCCc1cn2CCCc3cccc1c23
Show InChI InChI=1S/C15H18N2O/c1-11(18)16-8-7-13-10-17-9-3-5-12-4-2-6-14(13)15(12)17/h2,4,6,10H,3,5,7-9H2,1H3,(H,16,18)
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n/an/a 6.17E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair
Melatonin receptor 1C


(Xenopus laevis)
BDBM50411361
PNG
(CHEMBL396991)
Show SMILES CC(=O)NCC(C)(C)c1cn2CCCc3cccc1c23
Show InChI InChI=1S/C17H22N2O/c1-12(20)18-11-17(2,3)15-10-19-9-5-7-13-6-4-8-14(15)16(13)19/h4,6,8,10H,5,7,9,11H2,1-3H3,(H,18,20)
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PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Antagonist activity in Xenopus laevis melanophores assessed as melatoninergic activity after 60 mins


Citation and Details
More data for this
Ligand-Target Pair