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9 similar compounds to monomer 50230951

Compile data set for download or QSAR
Wt: 428.4
BDBM50230946
Wt: 289.3
BDBM50230952
Wt: 244.2
BDBM50230956
Wt: 359.4
BDBM50230949
Wt: 259.3
BDBM50230959
Wt: 273.3
BDBM50230961
Wt: 244.2
BDBM50230962
Wt: 422.2
BDBM50230950
Wt: 260.2
BDBM50230957

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 34 hits for monomerid = 50230946,50230952,50230956,50230949,50230959,50230961,50230962,50230950,50230957   
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


(Homo sapiens (Human))
BDBM50230961
PNG
(CHEMBL4062947)
Show SMILES CCNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3O2/c1-3-16-15(19)17-10-9-12-6-4-5-11-7-8-13(20-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,19)
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0.0900n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230959
PNG
(CHEMBL4084612)
Show SMILES CNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H17N3O2/c1-15-14(18)16-9-8-11-5-3-4-10-6-7-12(19-2)17-13(10)11/h3-7H,8-9H2,1-2H3,(H2,15,16,18)
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0.0900n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230957
PNG
(CHEMBL4082097)
Show SMILES COC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O3/c1-18-12-7-6-10-4-3-5-11(13(10)16-12)8-9-15-14(17)19-2/h3-7H,8-9H2,1-2H3,(H,15,17)
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0.300n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230956
PNG
(CHEMBL4079784)
Show SMILES CNC(=O)CCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O2/c1-15-12(17)8-6-10-4-3-5-11-7-9-13(18-2)16-14(10)11/h3-5,7,9H,6,8H2,1-2H3,(H,15,17)
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0.300n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230952
PNG
(CHEMBL4079699)
Show SMILES CCNC(=S)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3OS/c1-3-16-15(20)17-10-9-12-6-4-5-11-7-8-13(19-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,20)
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0.400n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230959
PNG
(CHEMBL4084612)
Show SMILES CNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H17N3O2/c1-15-14(18)16-9-8-11-5-3-4-10-6-7-12(19-2)17-13(10)11/h3-7H,8-9H2,1-2H3,(H2,15,16,18)
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0.600n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230961
PNG
(CHEMBL4062947)
Show SMILES CCNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3O2/c1-3-16-15(19)17-10-9-12-6-4-5-11-7-8-13(20-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,19)
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0.800n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230962
PNG
(CHEMBL4094436)
Show SMILES COc1cnc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C14H16N2O2/c1-10(17)15-7-6-11-4-3-5-14-13(11)8-12(18-2)9-16-14/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)
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4n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT2 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230952
PNG
(CHEMBL4079699)
Show SMILES CCNC(=S)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3OS/c1-3-16-15(20)17-10-9-12-6-4-5-11-7-8-13(19-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,20)
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4n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50230950
PNG
(CHEMBL4096684)
Show SMILES CN1C(=O)\C(=N/CCc2ccc(cc2)S(N)(=O)=O)c2cc(Br)ccc12
Show InChI InChI=1S/C17H16BrN3O3S/c1-21-15-7-4-12(18)10-14(15)16(17(21)22)20-9-8-11-2-5-13(6-3-11)25(19,23)24/h2-7,10H,8-9H2,1H3,(H2,19,23,24)/b20-16-
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5.90n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230957
PNG
(CHEMBL4082097)
Show SMILES COC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O3/c1-18-12-7-6-10-4-3-5-11(13(10)16-12)8-9-15-14(17)19-2/h3-7H,8-9H2,1-2H3,(H,15,17)
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7n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230956
PNG
(CHEMBL4079784)
Show SMILES CNC(=O)CCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O2/c1-15-12(17)8-6-10-4-3-5-11-7-9-13(18-2)16-14(10)11/h3-5,7,9H,6,8H2,1-2H3,(H,15,17)
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8n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM50230950
PNG
(CHEMBL4096684)
Show SMILES CN1C(=O)\C(=N/CCc2ccc(cc2)S(N)(=O)=O)c2cc(Br)ccc12
Show InChI InChI=1S/C17H16BrN3O3S/c1-21-15-7-4-12(18)10-14(15)16(17(21)22)20-9-8-11-2-5-13(6-3-11)25(19,23)24/h2-7,10H,8-9H2,1H3,(H2,19,23,24)/b20-16-
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33n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 4 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50230949
PNG
(CHEMBL4096121)
Show SMILES COc1ccc2NC(=O)\C(=N/CCc3ccc(cc3)S(N)(=O)=O)c2c1
Show InChI InChI=1S/C17H17N3O4S/c1-24-12-4-7-15-14(10-12)16(17(21)20-15)19-9-8-11-2-5-13(6-3-11)25(18,22)23/h2-7,10H,8-9H2,1H3,(H2,18,22,23)(H,19,20,21)
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34n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM50230949
PNG
(CHEMBL4096121)
Show SMILES COc1ccc2NC(=O)\C(=N/CCc3ccc(cc3)S(N)(=O)=O)c2c1
Show InChI InChI=1S/C17H17N3O4S/c1-24-12-4-7-15-14(10-12)16(17(21)20-15)19-9-8-11-2-5-13(6-3-11)25(18,22)23/h2-7,10H,8-9H2,1H3,(H2,18,22,23)(H,19,20,21)
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43n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 4 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230962
PNG
(CHEMBL4094436)
Show SMILES COc1cnc2cccc(CCNC(C)=O)c2c1
Show InChI InChI=1S/C14H16N2O2/c1-10(17)15-7-6-11-4-3-5-14-13(11)8-12(18-2)9-16-14/h3-5,8-9H,6-7H2,1-2H3,(H,15,17)
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60n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in HEK or CHO cell membranes after 120 mins


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50230950
PNG
(CHEMBL4096684)
Show SMILES CN1C(=O)\C(=N/CCc2ccc(cc2)S(N)(=O)=O)c2cc(Br)ccc12
Show InChI InChI=1S/C17H16BrN3O3S/c1-21-15-7-4-12(18)10-14(15)16(17(21)22)20-9-8-11-2-5-13(6-3-11)25(19,23)24/h2-7,10H,8-9H2,1H3,(H2,19,23,24)/b20-16-
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65n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM50230949
PNG
(CHEMBL4096121)
Show SMILES COc1ccc2NC(=O)\C(=N/CCc3ccc(cc3)S(N)(=O)=O)c2c1
Show InChI InChI=1S/C17H17N3O4S/c1-24-12-4-7-15-14(10-12)16(17(21)20-15)19-9-8-11-2-5-13(6-3-11)25(18,22)23/h2-7,10H,8-9H2,1H3,(H2,18,22,23)(H,19,20,21)
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89n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 7 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM50230950
PNG
(CHEMBL4096684)
Show SMILES CN1C(=O)\C(=N/CCc2ccc(cc2)S(N)(=O)=O)c2cc(Br)ccc12
Show InChI InChI=1S/C17H16BrN3O3S/c1-21-15-7-4-12(18)10-14(15)16(17(21)22)20-9-8-11-2-5-13(6-3-11)25(19,23)24/h2-7,10H,8-9H2,1H3,(H2,19,23,24)/b20-16-
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178n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 7 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50230949
PNG
(CHEMBL4096121)
Show SMILES COc1ccc2NC(=O)\C(=N/CCc3ccc(cc3)S(N)(=O)=O)c2c1
Show InChI InChI=1S/C17H17N3O4S/c1-24-12-4-7-15-14(10-12)16(17(21)20-15)19-9-8-11-2-5-13(6-3-11)25(18,22)23/h2-7,10H,8-9H2,1H3,(H2,18,22,23)(H,19,20,21)
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206n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50230946
PNG
(CHEMBL4081098)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C2/NC(=O)\C(S2)=C2\C(=O)Nc3ccccc23)cc1
Show InChI InChI=1S/C19H16N4O4S2/c20-29(26,27)12-7-5-11(6-8-12)9-10-21-19-23-18(25)16(28-19)15-13-3-1-2-4-14(13)22-17(15)24/h1-8H,9-10H2,(H,22,24)(H2,20,26,27)(H,21,23,25)/b16-15-
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262n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM50230946
PNG
(CHEMBL4081098)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C2/NC(=O)\C(S2)=C2\C(=O)Nc3ccccc23)cc1
Show InChI InChI=1S/C19H16N4O4S2/c20-29(26,27)12-7-5-11(6-8-12)9-10-21-19-23-18(25)16(28-19)15-13-3-1-2-4-14(13)22-17(15)24/h1-8H,9-10H2,(H,22,24)(H2,20,26,27)(H,21,23,25)/b16-15-
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268n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 7 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM50230946
PNG
(CHEMBL4081098)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C2/NC(=O)\C(S2)=C2\C(=O)Nc3ccccc23)cc1
Show InChI InChI=1S/C19H16N4O4S2/c20-29(26,27)12-7-5-11(6-8-12)9-10-21-19-23-18(25)16(28-19)15-13-3-1-2-4-14(13)22-17(15)24/h1-8H,9-10H2,(H,22,24)(H2,20,26,27)(H,21,23,25)/b16-15-
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329n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 4 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50230946
PNG
(CHEMBL4081098)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C2/NC(=O)\C(S2)=C2\C(=O)Nc3ccccc23)cc1
Show InChI InChI=1S/C19H16N4O4S2/c20-29(26,27)12-7-5-11(6-8-12)9-10-21-19-23-18(25)16(28-19)15-13-3-1-2-4-14(13)22-17(15)24/h1-8H,9-10H2,(H,22,24)(H2,20,26,27)(H,21,23,25)/b16-15-
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875n/an/an/an/an/an/an/an/a



Kafrelsheikh University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay


Eur J Med Chem 127: 521-530 (2017)


Article DOI: 10.1016/j.ejmech.2017.01.017
BindingDB Entry DOI: 10.7270/Q2862JPH
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230961
PNG
(CHEMBL4062947)
Show SMILES CCNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3O2/c1-3-16-15(19)17-10-9-12-6-4-5-11-7-8-13(20-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,19)
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n/an/an/an/a 9.5n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT1 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230952
PNG
(CHEMBL4079699)
Show SMILES CCNC(=S)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3OS/c1-3-16-15(20)17-10-9-12-6-4-5-11-7-8-13(19-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,20)
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n/an/an/an/a 1.10n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT2 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230961
PNG
(CHEMBL4062947)
Show SMILES CCNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3O2/c1-3-16-15(19)17-10-9-12-6-4-5-11-7-8-13(20-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,19)
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n/an/an/an/a 0.200n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT2 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230959
PNG
(CHEMBL4084612)
Show SMILES CNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H17N3O2/c1-15-14(18)16-9-8-11-5-3-4-10-6-7-12(19-2)17-13(10)11/h3-7H,8-9H2,1-2H3,(H2,15,16,18)
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n/an/an/an/a 0.0900n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT2 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230956
PNG
(CHEMBL4079784)
Show SMILES CNC(=O)CCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O2/c1-15-12(17)8-6-10-4-3-5-11-7-9-13(18-2)16-14(10)11/h3-5,7,9H,6,8H2,1-2H3,(H,15,17)
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n/an/an/an/a 0.700n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT2 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230957
PNG
(CHEMBL4082097)
Show SMILES COC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O3/c1-18-12-7-6-10-4-3-5-11(13(10)16-12)8-9-15-14(17)19-2/h3-7H,8-9H2,1-2H3,(H,15,17)
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n/an/an/an/a 0.400n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT2 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230959
PNG
(CHEMBL4084612)
Show SMILES CNC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H17N3O2/c1-15-14(18)16-9-8-11-5-3-4-10-6-7-12(19-2)17-13(10)11/h3-7H,8-9H2,1-2H3,(H2,15,16,18)
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n/an/an/an/a 19n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT1 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230957
PNG
(CHEMBL4082097)
Show SMILES COC(=O)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O3/c1-18-12-7-6-10-4-3-5-11(13(10)16-12)8-9-15-14(17)19-2/h3-7H,8-9H2,1-2H3,(H,15,17)
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n/an/an/an/a>1.00E+3n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT1 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230956
PNG
(CHEMBL4079784)
Show SMILES CNC(=O)CCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C14H16N2O2/c1-15-12(17)8-6-10-4-3-5-11-7-9-13(18-2)16-14(10)11/h3-5,7,9H,6,8H2,1-2H3,(H,15,17)
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n/an/an/an/a 65n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT1 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair
Melatonin receptor


(Homo sapiens (Human))
BDBM50230952
PNG
(CHEMBL4079699)
Show SMILES CCNC(=S)NCCc1cccc2ccc(OC)nc12
Show InChI InChI=1S/C15H19N3OS/c1-3-16-15(20)17-10-9-12-6-4-5-11-7-8-13(19-2)18-14(11)12/h4-8H,3,9-10H2,1-2H3,(H2,16,17,20)
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n/an/an/an/a 31n/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Intrinsic activity at human MT1 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 127: 621-631 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.013
BindingDB Entry DOI: 10.7270/Q24F1SZS
More data for this
Ligand-Target Pair