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Compile Data Set for Download or QSAR

Found 74 hits Enz. Inhib. hit(s) with Target = 'Melatonin receptor type 1C'   
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
Melatonin receptor type 1C


(Gallus gallus)
BDBM50212943
PNG
(CHEMBL290895)
Show SMILES CCCC(=O)NC1CCCc2c1c1cc(OC)ccc1n2C
Show InChI InChI=1S/C18H24N2O2/c1-4-6-17(21)19-14-7-5-8-16-18(14)13-11-12(22-3)9-10-15(13)20(16)2/h9-11,14H,4-8H2,1-3H3,(H,19,21)
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0.378n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM9019
PNG
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)
Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
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0.590n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM9019
PNG
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)
Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
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0.590n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Xenopus)
BDBM85238
PNG
(5-MeOT-N-butanyl)
Show SMILES CCCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C18H25N3O2/c1-3-4-18(23)20-9-7-14-5-6-17-16(11-14)15(12-21-17)8-10-19-13(2)22/h5-6,11-12,21H,3-4,7-10H2,1-2H3,(H,19,22)(H,20,23)
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0.660n/an/an/an/an/an/an/an/a



King's College

Curated by PDSP Ki Database




Biol Cell 89: 531-7 (1997)


BindingDB Entry DOI: 10.7270/Q2JS9P06
More data for this
Ligand-Target Pair
Melatonin 1C


(Xenopus)
BDBM85238
PNG
(5-MeOT-N-butanyl)
Show SMILES CCCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C18H25N3O2/c1-3-4-18(23)20-9-7-14-5-6-17-16(11-14)15(12-21-17)8-10-19-13(2)22/h5-6,11-12,21H,3-4,7-10H2,1-2H3,(H,19,22)(H,20,23)
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0.660n/an/an/an/an/an/an/an/a



King's College London

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 358: 522-8 (1998)


BindingDB Entry DOI: 10.7270/Q2WW7G6S
More data for this
Ligand-Target Pair
Melatonin receptor type 1C


(Gallus gallus)
BDBM50282765
PNG
(CHEMBL38728 | N-(6-Methoxy-9-methyl-2,3,4,9-tetrah...)
Show SMILES COc1ccc2n(C)c3CCCC(NC(C)=O)c3c2c1
Show InChI InChI=1S/C16H20N2O2/c1-10(19)17-13-5-4-6-15-16(13)12-9-11(20-3)7-8-14(12)18(15)2/h7-9,13H,4-6H2,1-3H3,(H,17,19)
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0.970n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Xenopus)
BDBM85239
PNG
(5-MeOT-N-propionyl)
Show SMILES CCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-3-17(22)19-8-6-13-4-5-16-15(10-13)14(11-20-16)7-9-18-12(2)21/h4-5,10-11,20H,3,6-9H2,1-2H3,(H,18,21)(H,19,22)
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1.25n/an/an/an/an/an/an/an/a



King's College London

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 358: 522-8 (1998)


BindingDB Entry DOI: 10.7270/Q2WW7G6S
More data for this
Ligand-Target Pair
Melatonin 1C


(Xenopus)
BDBM85239
PNG
(5-MeOT-N-propionyl)
Show SMILES CCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C17H23N3O2/c1-3-17(22)19-8-6-13-4-5-16-15(10-13)14(11-20-16)7-9-18-12(2)21/h4-5,10-11,20H,3,6-9H2,1-2H3,(H,18,21)(H,19,22)
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1.27n/an/an/an/an/an/an/an/a



King's College

Curated by PDSP Ki Database




Biol Cell 89: 531-7 (1997)


BindingDB Entry DOI: 10.7270/Q2JS9P06
More data for this
Ligand-Target Pair
Melatonin receptor type 1C


(Gallus gallus)
BDBM50212924
PNG
(CHEMBL441966)
Show SMILES CCC(=O)NC1CCCc2c1c1cc(OC)ccc1n2C
Show InChI InChI=1S/C17H22N2O2/c1-4-16(20)18-13-6-5-7-15-17(13)12-10-11(21-3)8-9-14(12)19(15)2/h8-10,13H,4-7H2,1-3H3,(H,18,20)
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1.40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Xenopus)
BDBM9019
PNG
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)
Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
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1.86n/an/an/an/an/an/an/an/a



King's College London

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 358: 522-8 (1998)


BindingDB Entry DOI: 10.7270/Q2WW7G6S
More data for this
Ligand-Target Pair
Melatonin 1C


(Xenopus)
BDBM9019
PNG
(CHEMBL45 | Melatonin | N-[2-(5-methoxy-1H-indol-3-...)
Show SMILES COc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)
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1.87n/an/an/an/an/an/an/an/a



King's College

Curated by PDSP Ki Database




Biol Cell 89: 531-7 (1997)


BindingDB Entry DOI: 10.7270/Q2JS9P06
More data for this
Ligand-Target Pair
Melatonin receptor type 1C


(Gallus gallus)
BDBM50212946
PNG
(CHEMBL288225)
Show SMILES COc1ccc2n(C)c3CCCC(NC(=O)C(F)(F)F)c3c2c1
Show InChI InChI=1S/C16H17F3N2O2/c1-21-12-7-6-9(23-2)8-10(12)14-11(4-3-5-13(14)21)20-15(22)16(17,18)19/h6-8,11H,3-5H2,1-2H3,(H,20,22)
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2n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212920
PNG
(CHEMBL39187)
Show SMILES CCCC(=O)NCCc1c(Br)[nH]c2cc(Br)ccc12
Show InChI InChI=1S/C14H16Br2N2O/c1-2-3-13(19)17-7-6-11-10-5-4-9(15)8-12(10)18-14(11)16/h4-5,8,18H,2-3,6-7H2,1H3,(H,17,19)
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2.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212931
PNG
(CHEMBL38520)
Show SMILES COc1ccc2[nH]c3CCC(Cc3c2c1)NC(=O)CBr
Show InChI InChI=1S/C15H17BrN2O2/c1-20-10-3-5-14-12(7-10)11-6-9(17-15(19)8-16)2-4-13(11)18-14/h3,5,7,9,18H,2,4,6,8H2,1H3,(H,17,19)
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8.30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212917
PNG
(CHEMBL43083)
Show SMILES BrCC(=O)NCCc1c(Br)[nH]c2ccccc12
Show InChI InChI=1S/C12H12Br2N2O/c13-7-11(17)15-6-5-9-8-3-1-2-4-10(8)16-12(9)14/h1-4,16H,5-7H2,(H,15,17)
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14n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212914
PNG
(CHEMBL39667)
Show SMILES CCC(=O)NCCc1c(Br)[nH]c2cc(Br)ccc12
Show InChI InChI=1S/C13H14Br2N2O/c1-2-12(18)16-6-5-10-9-4-3-8(14)7-11(9)17-13(10)15/h3-4,7,17H,2,5-6H2,1H3,(H,16,18)
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27n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212947
PNG
(CHEMBL287988)
Show SMILES COc1ccc2n(C)c3CCCC(NC(=O)C4CC4)c3c2c1
Show InChI InChI=1S/C18H22N2O2/c1-20-15-9-8-12(22-2)10-13(15)17-14(4-3-5-16(17)20)19-18(21)11-6-7-11/h8-11,14H,3-7H2,1-2H3,(H,19,21)
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30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212948
PNG
(CHEMBL287776)
Show SMILES CCC(=O)NC1CCc2[nH]c3ccc(OC)cc3c2C1
Show InChI InChI=1S/C16H20N2O2/c1-3-16(19)17-10-4-6-14-12(8-10)13-9-11(20-2)5-7-15(13)18-14/h5,7,9-10,18H,3-4,6,8H2,1-2H3,(H,17,19)
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41n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212915
PNG
(CHEMBL14559)
Show SMILES BrCC(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C18H17BrN2O/c19-12-17(22)20-11-10-15-14-8-4-5-9-16(14)21-18(15)13-6-2-1-3-7-13/h1-9,21H,10-12H2,(H,20,22)
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55n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Xenopus)
BDBM85240
PNG
(5-MeOT-N-pentanyl)
Show SMILES CCCCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C19H27N3O2/c1-3-4-5-19(24)21-10-8-15-6-7-18-17(12-15)16(13-22-18)9-11-20-14(2)23/h6-7,12-13,22H,3-5,8-11H2,1-2H3,(H,20,23)(H,21,24)
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57.4n/an/an/an/an/an/an/an/a



King's College

Curated by PDSP Ki Database




Biol Cell 89: 531-7 (1997)


BindingDB Entry DOI: 10.7270/Q2JS9P06
More data for this
Ligand-Target Pair
Melatonin 1C


(Xenopus)
BDBM85240
PNG
(5-MeOT-N-pentanyl)
Show SMILES CCCCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C19H27N3O2/c1-3-4-5-19(24)21-10-8-15-6-7-18-17(12-15)16(13-22-18)9-11-20-14(2)23/h6-7,12-13,22H,3-5,8-11H2,1-2H3,(H,20,23)(H,21,24)
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57.5n/an/an/an/an/an/an/an/a



King's College London

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 358: 522-8 (1998)


BindingDB Entry DOI: 10.7270/Q2WW7G6S
More data for this
Ligand-Target Pair
Melatonin receptor type 1C


(Gallus gallus)
BDBM50212908
PNG
(CHEMBL15013)
Show SMILES CCC(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C19H20N2O/c1-2-18(22)20-13-12-16-15-10-6-7-11-17(15)21-19(16)14-8-4-3-5-9-14/h3-11,21H,2,12-13H2,1H3,(H,20,22)
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70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212940
PNG
(CHEMBL288198)
Show SMILES CCCCC(=O)NC1CCCc2c1c1cc(OC)ccc1n2C
Show InChI InChI=1S/C19H26N2O2/c1-4-5-9-18(22)20-15-7-6-8-17-19(15)14-12-13(23-3)10-11-16(14)21(17)2/h10-12,15H,4-9H2,1-3H3,(H,20,22)
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82n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212918
PNG
(CHEMBL40140)
Show SMILES CCCC(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C14H18N2O/c1-2-5-14(17)15-9-8-11-10-16-13-7-4-3-6-12(11)13/h3-4,6-7,10,16H,2,5,8-9H2,1H3,(H,15,17)
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98n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212913
PNG
(CHEMBL15318)
Show SMILES CC(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C18H18N2O/c1-13(21)19-12-11-16-15-9-5-6-10-17(15)20-18(16)14-7-3-2-4-8-14/h2-10,20H,11-12H2,1H3,(H,19,21)
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100n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212942
PNG
(CHEMBL417343)
Show SMILES COc1ccc2[nH]c3CCC(Cc3c2c1)NC(=O)C(F)(F)F
Show InChI InChI=1S/C15H15F3N2O2/c1-22-9-3-5-13-11(7-9)10-6-8(2-4-12(10)20-13)19-14(21)15(16,17)18/h3,5,7-8,20H,2,4,6H2,1H3,(H,19,21)
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102n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212905
PNG
(CHEMBL15147)
Show SMILES CCCC(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C20H22N2O/c1-2-8-19(23)21-14-13-17-16-11-6-7-12-18(16)22-20(17)15-9-4-3-5-10-15/h3-7,9-12,22H,2,8,13-14H2,1H3,(H,21,23)
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112n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212906
PNG
(CHEMBL39998)
Show SMILES CC(=O)NCCc1c(Br)[nH]c2cc(Br)ccc12
Show InChI InChI=1S/C12H12Br2N2O/c1-7(17)15-5-4-10-9-3-2-8(13)6-11(9)16-12(10)14/h2-3,6,16H,4-5H2,1H3,(H,15,17)
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122n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212911
PNG
(CHEMBL289942)
Show SMILES Brc1[nH]c2cc(Br)ccc2c1CCNC(=O)C1CC1
Show InChI InChI=1S/C14H14Br2N2O/c15-9-3-4-10-11(13(16)18-12(10)7-9)5-6-17-14(19)8-1-2-8/h3-4,7-8,18H,1-2,5-6H2,(H,17,19)
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138n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212912
PNG
(CHEMBL43190)
Show SMILES CC(=O)NCCc1c(Br)[nH]c2ccccc12
Show InChI InChI=1S/C12H13BrN2O/c1-8(16)14-7-6-10-9-4-2-3-5-11(9)15-12(10)13/h2-5,15H,6-7H2,1H3,(H,14,16)
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138n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212921
PNG
(CHEMBL278183)
Show SMILES FC(F)(F)C(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C18H15F3N2O/c19-18(20,21)17(24)22-11-10-14-13-8-4-5-9-15(13)23-16(14)12-6-2-1-3-7-12/h1-9,23H,10-11H2,(H,22,24)
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148n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212945
PNG
(CHEMBL289549)
Show SMILES CCC(=O)NC1CCCc2c1c1ccccc1n2C
Show InChI InChI=1S/C16H20N2O/c1-3-15(19)17-12-8-6-10-14-16(12)11-7-4-5-9-13(11)18(14)2/h4-5,7,9,12H,3,6,8,10H2,1-2H3,(H,17,19)
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204n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212907
PNG
(CHEMBL274045)
Show SMILES O=C(NCCc1c([nH]c2ccccc12)-c1ccccc1)C1CC1
Show InChI InChI=1S/C20H20N2O/c23-20(15-10-11-15)21-13-12-17-16-8-4-5-9-18(16)22-19(17)14-6-2-1-3-7-14/h1-9,15,22H,10-13H2,(H,21,23)
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213n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212930
PNG
(CHEMBL287944)
Show SMILES CCCC(=O)NC1CCCc2c1c1ccccc1n2C
Show InChI InChI=1S/C17H22N2O/c1-3-7-16(20)18-13-9-6-11-15-17(13)12-8-4-5-10-14(12)19(15)2/h4-5,8,10,13H,3,6-7,9,11H2,1-2H3,(H,18,20)
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215n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212939
PNG
(CHEMBL41105)
Show SMILES COc1ccc2[nH]c3CCC(Cc3c2c1)NC(C)=O
Show InChI InChI=1S/C15H18N2O2/c1-9(18)16-10-3-5-14-12(7-10)13-8-11(19-2)4-6-15(13)17-14/h4,6,8,10,17H,3,5,7H2,1-2H3,(H,16,18)
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219n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212922
PNG
(CHEMBL290903)
Show SMILES CC(=O)NC1CCCc2c1c1ccccc1n2C
Show InChI InChI=1S/C15H18N2O/c1-10(18)16-12-7-5-9-14-15(12)11-6-3-4-8-13(11)17(14)2/h3-4,6,8,12H,5,7,9H2,1-2H3,(H,16,18)
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227n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50066960
PNG
(CHEMBL33700 | N-(2-(5-methoxy-1-methyl-1H-indol-3-...)
Show SMILES COc1ccc2n(C)cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C14H18N2O2/c1-10(17)15-7-6-11-9-16(2)14-5-4-12(18-3)8-13(11)14/h4-5,8-9H,6-7H2,1-3H3,(H,15,17)
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254n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212932
PNG
(CHEMBL38587)
Show SMILES COc1ccc2n(C)c3CCCC(NC(=O)C4CCC4)c3c2c1
Show InChI InChI=1S/C19H24N2O2/c1-21-16-10-9-13(23-2)11-14(16)18-15(7-4-8-17(18)21)20-19(22)12-5-3-6-12/h9-12,15H,3-8H2,1-2H3,(H,20,22)
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271n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212919
PNG
(CHEMBL39903)
Show SMILES FC(F)(F)C(=O)NCCc1c(Br)[nH]c2cc(Br)ccc12
Show InChI InChI=1S/C12H9Br2F3N2O/c13-6-1-2-7-8(10(14)19-9(7)5-6)3-4-18-11(20)12(15,16)17/h1-2,5,19H,3-4H2,(H,18,20)
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367n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212909
PNG
(CHEMBL42867)
Show SMILES FC(F)(F)C(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C12H11F3N2O/c13-12(14,15)11(18)16-6-5-8-7-17-10-4-2-1-3-9(8)10/h1-4,7,17H,5-6H2,(H,16,18)
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377n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212910
PNG
(CHEMBL37514)
Show SMILES CCC(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C13H16N2O/c1-2-13(16)14-8-7-10-9-15-12-6-4-3-5-11(10)12/h3-6,9,15H,2,7-8H2,1H3,(H,14,16)
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398n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212934
PNG
(CHEMBL41148)
Show SMILES CCC(=O)NC1CCc2[nH]c3ccccc3c2C1
Show InChI InChI=1S/C15H18N2O/c1-2-15(18)16-10-7-8-14-12(9-10)11-5-3-4-6-13(11)17-14/h3-6,10,17H,2,7-9H2,1H3,(H,16,18)
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436n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212944
PNG
(CHEMBL290271)
Show SMILES CCCC(=O)NC1CCc2[nH]c3ccc(OC)cc3c2C1
Show InChI InChI=1S/C17H22N2O2/c1-3-4-17(20)18-11-5-7-15-13(9-11)14-10-12(21-2)6-8-16(14)19-15/h6,8,10-11,19H,3-5,7,9H2,1-2H3,(H,18,20)
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560n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212941
PNG
(CHEMBL288206)
Show SMILES COc1ccc2[nH]c3CCC(Cc3c2c1)NC(=O)C1CC1
Show InChI InChI=1S/C17H20N2O2/c1-21-12-5-7-16-14(9-12)13-8-11(4-6-15(13)19-16)18-17(20)10-2-3-10/h5,7,9-11,19H,2-4,6,8H2,1H3,(H,18,20)
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570n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50282758
PNG
(CHEMBL33171 | N-Acetyltryptamine | N-[2-(1H-Indol-...)
Show SMILES CC(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C12H14N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,8,14H,6-7H2,1H3,(H,13,15)
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701n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212933
PNG
(CHEMBL291120)
Show SMILES BrCC(=O)NC1CCc2[nH]c3ccccc3c2C1
Show InChI InChI=1S/C14H15BrN2O/c15-8-14(18)16-9-5-6-13-11(7-9)10-3-1-2-4-12(10)17-13/h1-4,9,17H,5-8H2,(H,16,18)
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740n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212938
PNG
(CHEMBL41744)
Show SMILES Cn1c2CCCC(NC(=O)C(F)(F)F)c2c2ccccc12
Show InChI InChI=1S/C15H15F3N2O/c1-20-11-7-3-2-5-9(11)13-10(6-4-8-12(13)20)19-14(21)15(16,17)18/h2-3,5,7,10H,4,6,8H2,1H3,(H,19,21)
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766n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Gallus gallus)
BDBM50212929
PNG
(CHEMBL38720)
Show SMILES CCCC(=O)NC1CCc2[nH]c3ccccc3c2C1
Show InChI InChI=1S/C16H20N2O/c1-2-5-16(19)17-11-8-9-15-13(10-11)12-6-3-4-7-14(12)18-15/h3-4,6-7,11,18H,2,5,8-10H2,1H3,(H,17,19)
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1.06E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity towards melatonin receptor was determined using 2-[125I]iodomelatonin as radioligand in chick brain membranes


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


(Xenopus)
BDBM85237
PNG
(5-MeOT-N-hexanyl)
Show SMILES CCCCCC(=O)NCCc1ccc2[nH]cc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C20H29N3O2/c1-3-4-5-6-20(25)22-11-9-16-7-8-19-18(13-16)17(14-23-19)10-12-21-15(2)24/h7-8,13-14,23H,3-6,9-12H2,1-2H3,(H,21,24)(H,22,25)
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PubMed
1.36E+3n/an/an/an/an/an/an/an/a



King's College

Curated by PDSP Ki Database




Biol Cell 89: 531-7 (1997)


BindingDB Entry DOI: 10.7270/Q2JS9P06
More data for this
Ligand-Target Pair
Melatonin 1C


(Xenopus)
BDBM85383
PNG
(Luzindole,5-MeOT-N-hexanyl)
Show SMILES CCCCCC(=O)NCCc1c(Cc2ccccc2)[nH]c2ccc(OC)cc12
Show InChI InChI=1S/C24H30N2O2/c1-3-4-6-11-24(27)25-15-14-20-21-17-19(28-2)12-13-22(21)26-23(20)16-18-9-7-5-8-10-18/h5,7-10,12-13,17,26H,3-4,6,11,14-16H2,1-2H3,(H,25,27)
UniProtKB/SwissProt

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PubMed
1.38E+3n/an/an/an/an/an/an/an/a



King's College London

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 358: 522-8 (1998)


BindingDB Entry DOI: 10.7270/Q2WW7G6S
More data for this
Ligand-Target Pair
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