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Compile Data Set for Download or QSAR

Found 25 hits of ki for UniProtKB: P51050   
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
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM29611
PNG
(2-Iodomelatonin | CHEMBL289233 | Melatonin,2-Iodo)
Show SMILES COc1ccc2[nH]c(I)c(CCNC(C)=O)c2c1
Show InChI InChI=1S/C13H15IN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)
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0.130n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231291
PNG
(CHEMBL421013)
Show SMILES COc1cc2c(CCNC(C)=O)c(C)[nH]c2c(Cl)c1Cl
Show InChI InChI=1S/C14H16Cl2N2O2/c1-7-9(4-5-17-8(2)19)10-6-11(20-3)12(15)13(16)14(10)18-7/h6,18H,4-5H2,1-3H3,(H,17,19)
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0.230n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231307
PNG
(CHEMBL34622)
Show SMILES CCC(=O)NCCc1c[nH]c2ccc(OC)cc12
Show InChI InChI=1S/C14H18N2O2/c1-3-14(17)15-7-6-10-9-16-13-5-4-11(18-2)8-12(10)13/h4-5,8-9,16H,3,6-7H2,1-2H3,(H,15,17)
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0.270n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50043289
PNG
(CHEMBL34730 | N-[2-(6-Chloro-5-methoxy-1H-indol-3-...)
Show SMILES COc1cc2c(CCNC(C)=O)c[nH]c2cc1Cl
Show InChI InChI=1S/C13H15ClN2O2/c1-8(17)15-4-3-9-7-16-12-6-11(14)13(18-2)5-10(9)12/h5-7,16H,3-4H2,1-2H3,(H,15,17)
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0.340n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
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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0.570n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231304
PNG
(CHEMBL288084)
Show SMILES CCCC(=O)NCCc1c[nH]c2ccc(OC)cc12
Show InChI InChI=1S/C15H20N2O2/c1-3-4-15(18)16-8-7-11-10-17-14-6-5-12(19-2)9-13(11)14/h5-6,9-10,17H,3-4,7-8H2,1-2H3,(H,16,18)
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0.730n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231302
PNG
(CHEMBL99376)
Show SMILES CCCC(=O)NC1CCc2cccc(OC)c2C1
Show InChI InChI=1S/C15H21NO2/c1-3-5-15(17)16-12-9-8-11-6-4-7-14(18-2)13(11)10-12/h4,6-7,12H,3,5,8-10H2,1-2H3,(H,16,17)
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3.60n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231292
PNG
(CHEMBL95920)
Show SMILES COc1cccc2CCC(Cc12)NC(=O)CCl
Show InChI InChI=1S/C13H16ClNO2/c1-17-12-4-2-3-9-5-6-10(7-11(9)12)15-13(16)8-14/h2-4,10H,5-8H2,1H3,(H,15,16)
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3.80n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50045843
PNG
(8-M-PDOT | CHEMBL99377 | N-(8-Methoxy-1,2,3,4-tetr...)
Show SMILES CCC(=O)NC1CCc2cccc(OC)c2C1
Show InChI InChI=1S/C14H19NO2/c1-3-14(16)15-11-8-7-10-5-4-6-13(17-2)12(10)9-11/h4-6,11H,3,7-9H2,1-2H3,(H,15,16)
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7.40n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231298
PNG
(CHEMBL330385)
Show SMILES CCCC(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C14H19NO/c1-2-5-14(16)15-13-9-8-11-6-3-4-7-12(11)10-13/h3-4,6-7,13H,2,5,8-10H2,1H3,(H,15,16)
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44n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50035176
PNG
(8-M-ADOT | CHEMBL53015 | N-(8-Methoxy-1,2,3,4-tetr...)
Show SMILES COc1cccc2CCC(Cc12)NC(C)=O
Show InChI InChI=1S/C13H17NO2/c1-9(15)14-11-7-6-10-4-3-5-13(16-2)12(10)8-11/h3-5,11H,6-8H2,1-2H3,(H,14,15)
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46n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231294
PNG
(CHEMBL95266)
Show SMILES ClCC(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C12H14ClNO/c13-8-12(15)14-11-6-5-9-3-1-2-4-10(9)7-11/h1-4,11H,5-8H2,(H,14,15)
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95n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231296
PNG
(CHEMBL316854)
Show SMILES COc1ccc2CCC(Cc2c1)NC(C)=O
Show InChI InChI=1S/C13H17NO2/c1-9(15)14-12-5-3-10-4-6-13(16-2)8-11(10)7-12/h4,6,8,12H,3,5,7H2,1-2H3,(H,14,15)
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121n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231303
PNG
(CHEMBL95364)
Show SMILES COc1cccc2CCC(Cc12)NC(=O)C1CC1
Show InChI InChI=1S/C15H19NO2/c1-18-14-4-2-3-10-7-8-12(9-13(10)14)16-15(17)11-5-6-11/h2-4,11-12H,5-9H2,1H3,(H,16,17)
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141n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231301
PNG
(CHEMBL421569)
Show SMILES CCC(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C13H17NO/c1-2-13(15)14-12-8-7-10-5-3-4-6-11(10)9-12/h3-6,12H,2,7-9H2,1H3,(H,14,15)
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145n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50282747
PNG
(2-Bromo-N-[2-(1H-indol-3-yl)-ethyl]-acetamide | AA...)
Show SMILES BrCC(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C12H13BrN2O/c13-7-12(16)14-6-5-9-8-15-11-4-2-1-3-10(9)11/h1-4,8,15H,5-7H2,(H,14,16)
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153n/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

BindingDB Entry DOI: 10.7270/Q2HQ422R
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231299
PNG
(CHEMBL95851)
Show SMILES COc1cccc2CCC(Cc12)NC(=O)C(C)C
Show InChI InChI=1S/C15H21NO2/c1-10(2)15(17)16-12-8-7-11-5-4-6-14(18-3)13(11)9-12/h4-6,10,12H,7-9H2,1-3H3,(H,16,17)
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312n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231305
PNG
(CHEMBL52801)
Show SMILES COc1ccccc1CCNC(C)=O
Show InChI InChI=1S/C11H15NO2/c1-9(13)12-8-7-10-5-3-4-6-11(10)14-2/h3-6H,7-8H2,1-2H3,(H,12,13)
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420n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231306
PNG
(CHEMBL53722)
Show SMILES COc1cccc(CCNC(C)=O)c1
Show InChI InChI=1S/C11H15NO2/c1-9(13)12-7-6-10-4-3-5-11(8-10)14-2/h3-5,8H,6-7H2,1-2H3,(H,12,13)
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581n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231295
PNG
(CHEMBL322193)
Show SMILES CC(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C12H15NO/c1-9(14)13-12-7-6-10-4-2-3-5-11(10)8-12/h2-5,12H,6-8H2,1H3,(H,13,14)
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665n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231308
PNG
(CHEMBL299966)
Show SMILES CCCC(=O)NCCc1ccccc1OC
Show InChI InChI=1S/C13H19NO2/c1-3-6-13(15)14-10-9-11-7-4-5-8-12(11)16-2/h4-5,7-8H,3,6,9-10H2,1-2H3,(H,14,15)
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748n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231300
PNG
(CHEMBL50943)
Show SMILES CCC(=O)NCCc1ccccc1OC
Show InChI InChI=1S/C12H17NO2/c1-3-12(14)13-9-8-10-6-4-5-7-11(10)15-2/h4-7H,3,8-9H2,1-2H3,(H,13,14)
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789n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231293
PNG
(CHEMBL95366)
Show SMILES COc1cccc2CC(CCc12)NC(C)=O
Show InChI InChI=1S/C13H17NO2/c1-9(15)14-11-6-7-12-10(8-11)4-3-5-13(12)16-2/h3-5,11H,6-8H2,1-2H3,(H,14,15)
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1.95E+3n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50231297
PNG
(CHEMBL99778)
Show SMILES COc1cccc2CCC(Cc12)NC(=O)c1ccccc1
Show InChI InChI=1S/C18H19NO2/c1-21-17-9-5-8-13-10-11-15(12-16(13)17)19-18(20)14-6-3-2-4-7-14/h2-9,15H,10-12H2,1H3,(H,19,20)
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Article
PubMed
2.31E+4n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair
Melatonin receptor type 1A/1B/1C


(Gallus gallus-Chick)
BDBM50020512
PNG
(6-Methoxy-1,2,3,4-tetrahydro-naphthalen-2-ylamine ...)
Show SMILES COc1ccc2CC(N)CCc2c1
Show InChI InChI=1S/C11H15NO/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h3,5,7,10H,2,4,6,12H2,1H3
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PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



University of Groningen

Curated by ChEMBL


Assay Description
Binding affinity to compete for 2-[125I]iodomelatonin binding to chicken retinal membranes


J Med Chem 36: 2891-8 (1993)


Article DOI: 10.1021/jm00072a008
BindingDB Entry DOI: 10.7270/Q2HT2RJK
More data for this
Ligand-Target Pair