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Compile Data Set for Download or QSAR

Found 39 hits from Argenta Discovery Limited   
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
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50002739
PNG
(ADS-103317 | CHEMBL217062)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3cccc(Cl)c3)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-18-12-16(24-20(27)13-28-17-6-4-5-15(22)11-17)7-8-19(18)25-21(23-14)26-9-2-3-10-26/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,24,27)
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n/an/a 7n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of 125I-[Phe13,Tyr19]-MCH binding to MCH-R1 expressing cell membranes at 1uM


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200783
PNG
(ADS-103168 | CHEMBL424739 | N-(2-(pyrrolidin-1-yl)...)
Show SMILES FC(F)(F)c1ccc(OCC(=O)Nc2ccc3nc([nH]c3c2)N2CCCC2)cc1
Show InChI InChI=1S/C20H19F3N4O2/c21-20(22,23)13-3-6-15(7-4-13)29-12-18(28)24-14-5-8-16-17(11-14)26-19(25-16)27-9-1-2-10-27/h3-8,11H,1-2,9-10,12H2,(H,24,28)(H,25,26)
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n/an/a 9n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200793
PNG
(ADS-103214 | CHEMBL216430 | N-(1-methyl-2-(pyrroli...)
Show SMILES Cn1c(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C21H21F3N4O2/c1-27-18-12-15(6-9-17(18)26-20(27)28-10-2-3-11-28)25-19(29)13-30-16-7-4-14(5-8-16)21(22,23)24/h4-9,12H,2-3,10-11,13H2,1H3,(H,25,29)
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n/an/a 9n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50150059
PNG
(CHEMBL183215 | N-(4-Methyl-2-pyrrolidin-1-yl-quino...)
Show SMILES Cc1cc(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C23H22F3N3O2/c1-15-12-21(29-10-2-3-11-29)28-20-9-6-17(13-19(15)20)27-22(30)14-31-18-7-4-16(5-8-18)23(24,25)26/h4-9,12-13H,2-3,10-11,14H2,1H3,(H,27,30)
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n/an/a 10n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Tested for MCH-1 induced [Ca2+] release from CHO cells transfected with human MCH-1R


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50150059
PNG
(CHEMBL183215 | N-(4-Methyl-2-pyrrolidin-1-yl-quino...)
Show SMILES Cc1cc(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C23H22F3N3O2/c1-15-12-21(29-10-2-3-11-29)28-20-9-6-17(13-19(15)20)27-22(30)14-31-18-7-4-16(5-8-18)23(24,25)26/h4-9,12-13H,2-3,10-11,14H2,1H3,(H,27,30)
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n/an/a 10n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50150059
PNG
(CHEMBL183215 | N-(4-Methyl-2-pyrrolidin-1-yl-quino...)
Show SMILES Cc1cc(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C23H22F3N3O2/c1-15-12-21(29-10-2-3-11-29)28-20-9-6-17(13-19(15)20)27-22(30)14-31-18-7-4-16(5-8-18)23(24,25)26/h4-9,12-13H,2-3,10-11,14H2,1H3,(H,27,30)
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n/an/a 15n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50241099
PNG
(ADS-103274 | CHEMBL276393 | N-(2-((2-(dimethylamin...)
Show SMILES CN(C)CCN(C)c1nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc2n1C
Show InChI InChI=1S/C22H26F3N5O2/c1-28(2)11-12-29(3)21-27-18-10-7-16(13-19(18)30(21)4)26-20(31)14-32-17-8-5-15(6-9-17)22(23,24)25/h5-10,13H,11-12,14H2,1-4H3,(H,26,31)
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n/an/a 25n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50241099
PNG
(ADS-103274 | CHEMBL276393 | N-(2-((2-(dimethylamin...)
Show SMILES CN(C)CCN(C)c1nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc2n1C
Show InChI InChI=1S/C22H26F3N5O2/c1-28(2)11-12-29(3)21-27-18-10-7-16(13-19(18)30(21)4)26-20(31)14-32-17-8-5-15(6-9-17)22(23,24)25/h5-10,13H,11-12,14H2,1-4H3,(H,26,31)
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n/an/a 28n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200783
PNG
(ADS-103168 | CHEMBL424739 | N-(2-(pyrrolidin-1-yl)...)
Show SMILES FC(F)(F)c1ccc(OCC(=O)Nc2ccc3nc([nH]c3c2)N2CCCC2)cc1
Show InChI InChI=1S/C20H19F3N4O2/c21-20(22,23)13-3-6-15(7-4-13)29-12-18(28)24-14-5-8-16-17(11-14)26-19(25-16)27-9-1-2-10-27/h3-8,11H,1-2,9-10,12H2,(H,24,28)(H,25,26)
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n/an/a 35n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50002738
PNG
(ADS-103255 | CHEMBL214899)
Show SMILES Cn1c(CN2CCNCC2)nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12
Show InChI InChI=1S/C22H24F3N5O2/c1-29-19-12-16(4-7-18(19)28-20(29)13-30-10-8-26-9-11-30)27-21(31)14-32-17-5-2-15(3-6-17)22(23,24)25/h2-7,12,26H,8-11,13-14H2,1H3,(H,27,31)
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n/an/a 37n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of 125I-[Phe13,Tyr19]-MCH binding to MCH-R1 expressing cell membranes at 1uM


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200793
PNG
(ADS-103214 | CHEMBL216430 | N-(1-methyl-2-(pyrroli...)
Show SMILES Cn1c(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C21H21F3N4O2/c1-27-18-12-15(6-9-17(18)26-20(27)28-10-2-3-11-28)25-19(29)13-30-16-7-4-14(5-8-16)21(22,23)24/h4-9,12H,2-3,10-11,13H2,1H3,(H,25,29)
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n/an/a 40n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200790
PNG
(2-(4-methoxyphenoxy)-N-(4-methyl-2-(pyrrolidin-1-y...)
Show SMILES COc1ccc(OCC(=O)Nc2ccc3nc(nc(C)c3c2)N2CCCC2)cc1
Show InChI InChI=1S/C22H24N4O3/c1-15-19-13-16(5-10-20(19)25-22(23-15)26-11-3-4-12-26)24-21(27)14-29-18-8-6-17(28-2)7-9-18/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,24,27)
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n/an/a 41n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200788
PNG
(2-(4-chlorophenoxy)-N-(4-methyl-2-(pyrrolidin-1-yl...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-18-12-16(24-20(27)13-28-17-7-4-15(22)5-8-17)6-9-19(18)25-21(23-14)26-10-2-3-11-26/h4-9,12H,2-3,10-11,13H2,1H3,(H,24,27)
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n/an/a 58n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50150063
PNG
(CHEMBL364863 | N-[4-Methyl-2-(4-methyl-piperazin-1...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(cc3)C(F)(F)F)ccc2n1
Show InChI InChI=1S/C24H25F3N4O2/c1-16-13-22(31-11-9-30(2)10-12-31)29-21-8-5-18(14-20(16)21)28-23(32)15-33-19-6-3-17(4-7-19)24(25,26)27/h3-8,13-14H,9-12,15H2,1-2H3,(H,28,32)
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n/an/a 63n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Tested for MCH-1 induced [Ca2+] release from CHO cells transfected with human MCH-1R


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200791
PNG
(ADS-103294 | CHEMBL214678 | N-(2-(isopropylamino)-...)
Show SMILES CC(C)Nc1nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc2n1C
Show InChI InChI=1S/C20H21F3N4O2/c1-12(2)24-19-26-16-9-6-14(10-17(16)27(19)3)25-18(28)11-29-15-7-4-13(5-8-15)20(21,22)23/h4-10,12H,11H2,1-3H3,(H,24,26)(H,25,28)
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n/an/a 70n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50150057
PNG
(2-(4-Chloro-phenoxy)-N-[4-methyl-2-(4-methyl-piper...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C23H25ClN4O2/c1-16-13-22(28-11-9-27(2)10-12-28)26-21-8-5-18(14-20(16)21)25-23(29)15-30-19-6-3-17(24)4-7-19/h3-8,13-14H,9-12,15H2,1-2H3,(H,25,29)
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n/an/a 71n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Tested for MCH-1 induced [Ca2+] release from CHO cells transfected with human MCH-1R


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200792
PNG
(ADS-102891 | CHEMBL424728 | N-(4-methyl-2-(pyrroli...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C22H21F3N4O2/c1-14-18-12-16(6-9-19(18)28-21(26-14)29-10-2-3-11-29)27-20(30)13-31-17-7-4-15(5-8-17)22(23,24)25/h4-9,12H,2-3,10-11,13H2,1H3,(H,27,30)
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n/an/a 100n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200791
PNG
(ADS-103294 | CHEMBL214678 | N-(2-(isopropylamino)-...)
Show SMILES CC(C)Nc1nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc2n1C
Show InChI InChI=1S/C20H21F3N4O2/c1-12(2)24-19-26-16-9-6-14(10-17(16)27(19)3)25-18(28)11-29-15-7-4-13(5-8-15)20(21,22)23/h4-10,12H,11H2,1-3H3,(H,24,26)(H,25,28)
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n/an/a 101n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200794
PNG
(CHEMBL216407 | N-(2-(piperazin-1-ylmethyl)quinolin...)
Show SMILES FC(F)(F)c1ccc(OCC(=O)Nc2ccc3nc(CN4CCNCC4)ccc3c2)cc1
Show InChI InChI=1S/C23H23F3N4O2/c24-23(25,26)17-2-6-20(7-3-17)32-15-22(31)29-18-5-8-21-16(13-18)1-4-19(28-21)14-30-11-9-27-10-12-30/h1-8,13,27H,9-12,14-15H2,(H,29,31)
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n/an/a 122n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50150064
PNG
(CHEMBL182886 | N-(4-Methyl-2-morpholin-4-yl-quinol...)
Show SMILES Cc1cc(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCOCC1
Show InChI InChI=1S/C23H22F3N3O3/c1-15-12-21(29-8-10-31-11-9-29)28-20-7-4-17(13-19(15)20)27-22(30)14-32-18-5-2-16(3-6-18)23(24,25)26/h2-7,12-13H,8-11,14H2,1H3,(H,27,30)
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n/an/a 124n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Tested for MCH-1 induced [Ca2+] release from CHO cells transfected with human MCH-1R


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200785
PNG
(ADS-103254 | CHEMBL217712 | N-(2-((2-(dimethylamin...)
Show SMILES CN(C)CCN(C)c1nc(C)c2cc(NC(=O)COc3ccc(cc3)C(F)(F)F)ccc2n1
Show InChI InChI=1S/C23H26F3N5O2/c1-15-19-13-17(7-10-20(19)29-22(27-15)31(4)12-11-30(2)3)28-21(32)14-33-18-8-5-16(6-9-18)23(24,25)26/h5-10,13H,11-12,14H2,1-4H3,(H,28,32)
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n/an/a 164n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-mediated calcium influx into MCH-R1 expressing cells


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200792
PNG
(ADS-102891 | CHEMBL424728 | N-(4-methyl-2-(pyrroli...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc12)N1CCCC1
Show InChI InChI=1S/C22H21F3N4O2/c1-14-18-12-16(6-9-19(18)28-21(26-14)29-10-2-3-11-29)27-20(30)13-31-17-7-4-15(5-8-17)22(23,24)25/h4-9,12H,2-3,10-11,13H2,1H3,(H,27,30)
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n/an/a 165n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200784
PNG
(CHEMBL217459 | N-(2-morpholinoquinolin-6-yl)-2-(4-...)
Show SMILES FC(F)(F)c1ccc(OCC(=O)Nc2ccc3nc(ccc3c2)N2CCOCC2)cc1
Show InChI InChI=1S/C22H20F3N3O3/c23-22(24,25)16-2-5-18(6-3-16)31-14-21(29)26-17-4-7-19-15(13-17)1-8-20(27-19)28-9-11-30-12-10-28/h1-8,13H,9-12,14H2,(H,26,29)
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n/an/a 172n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50150072
PNG
(2-(2,3-Dichloro-phenoxy)-N-[4-methyl-2-(4-methyl-p...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3cccc(Cl)c3Cl)ccc2n1
Show InChI InChI=1S/C23H24Cl2N4O2/c1-15-12-21(29-10-8-28(2)9-11-29)27-19-7-6-16(13-17(15)19)26-22(30)14-31-20-5-3-4-18(24)23(20)25/h3-7,12-13H,8-11,14H2,1-2H3,(H,26,30)
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n/an/a 201n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against human 5-HT2B receptor


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200788
PNG
(2-(4-chlorophenoxy)-N-(4-methyl-2-(pyrrolidin-1-yl...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-18-12-16(24-20(27)13-28-17-7-4-15(22)5-8-17)6-9-19(18)25-21(23-14)26-10-2-3-11-26/h4-9,12H,2-3,10-11,13H2,1H3,(H,24,27)
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n/an/a 250n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200785
PNG
(ADS-103254 | CHEMBL217712 | N-(2-((2-(dimethylamin...)
Show SMILES CN(C)CCN(C)c1nc(C)c2cc(NC(=O)COc3ccc(cc3)C(F)(F)F)ccc2n1
Show InChI InChI=1S/C23H26F3N5O2/c1-15-19-13-17(7-10-20(19)29-22(27-15)31(4)12-11-30(2)3)28-21(32)14-33-18-8-5-16(6-9-18)23(24,25)26/h5-10,13H,11-12,14H2,1-4H3,(H,28,32)
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n/an/a 260n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50150057
PNG
(2-(4-Chloro-phenoxy)-N-[4-methyl-2-(4-methyl-piper...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C23H25ClN4O2/c1-16-13-22(28-11-9-27(2)10-12-28)26-21-8-5-18(14-20(16)21)25-23(29)15-30-19-6-3-17(24)4-7-19/h3-8,13-14H,9-12,15H2,1-2H3,(H,25,29)
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n/an/a 349n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against human 5-HT2B receptor


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200790
PNG
(2-(4-methoxyphenoxy)-N-(4-methyl-2-(pyrrolidin-1-y...)
Show SMILES COc1ccc(OCC(=O)Nc2ccc3nc(nc(C)c3c2)N2CCCC2)cc1
Show InChI InChI=1S/C22H24N4O3/c1-15-19-13-16(5-10-20(19)25-22(23-15)26-11-3-4-12-26)24-21(27)14-29-18-8-6-17(28-2)7-9-18/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,24,27)
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n/an/a 390n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50150061
PNG
(CHEMBL185376 | N-(2-Isopropylamino-4-methyl-quinol...)
Show SMILES CC(C)Nc1cc(C)c2cc(NC(=O)COc3ccc(cc3)C(F)(F)F)ccc2n1
Show InChI InChI=1S/C22H22F3N3O2/c1-13(2)26-20-10-14(3)18-11-16(6-9-19(18)28-20)27-21(29)12-30-17-7-4-15(5-8-17)22(23,24)25/h4-11,13H,12H2,1-3H3,(H,26,28)(H,27,29)
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n/an/a 400n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against human 5-HT2B receptor


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50150063
PNG
(CHEMBL364863 | N-[4-Methyl-2-(4-methyl-piperazin-1...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(cc3)C(F)(F)F)ccc2n1
Show InChI InChI=1S/C24H25F3N4O2/c1-16-13-22(31-11-9-30(2)10-12-31)29-21-8-5-18(14-20(16)21)28-23(32)15-33-19-6-3-17(4-7-19)24(25,26)27/h3-8,13-14H,9-12,15H2,1-2H3,(H,28,32)
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n/an/a 442n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against human 5-HT2B receptor


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200789
PNG
(2-(4-chlorophenoxy)-N-(2-morpholinoquinolin-6-yl)a...)
Show SMILES Clc1ccc(OCC(=O)Nc2ccc3nc(ccc3c2)N2CCOCC2)cc1
Show InChI InChI=1S/C21H20ClN3O3/c22-16-2-5-18(6-3-16)28-14-21(26)23-17-4-7-19-15(13-17)1-8-20(24-19)25-9-11-27-12-10-25/h1-8,13H,9-12,14H2,(H,23,26)
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n/an/a 961n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50150057
PNG
(2-(4-Chloro-phenoxy)-N-[4-methyl-2-(4-methyl-piper...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C23H25ClN4O2/c1-16-13-22(28-11-9-27(2)10-12-28)26-21-8-5-18(14-20(16)21)25-23(29)15-30-19-6-3-17(24)4-7-19/h3-8,13-14H,9-12,15H2,1-2H3,(H,25,29)
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n/an/a 970n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against human 5-HT2C receptor


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50241099
PNG
(ADS-103274 | CHEMBL276393 | N-(2-((2-(dimethylamin...)
Show SMILES CN(C)CCN(C)c1nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc2n1C
Show InChI InChI=1S/C22H26F3N5O2/c1-28(2)11-12-29(3)21-27-18-10-7-16(13-19(18)30(21)4)26-20(31)14-32-17-8-5-15(6-9-17)22(23,24)25/h5-10,13H,11-12,14H2,1-4H3,(H,26,31)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of 5HT2B


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Serotonin receptor (2b and 2c)


(Homo sapiens (human))
BDBM50200788
PNG
(2-(4-chlorophenoxy)-N-(4-methyl-2-(pyrrolidin-1-yl...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-18-12-16(24-20(27)13-28-17-7-4-15(22)5-8-17)6-9-19(18)25-21(23-14)26-10-2-3-11-26/h4-9,12H,2-3,10-11,13H2,1H3,(H,24,27)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of 5HT2B


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor


(Homo sapiens (human))
BDBM50200786
PNG
(2-(2-chlorophenoxy)-N-(4-methyl-2-(pyrrolidin-1-yl...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccccc3Cl)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-16-12-15(24-20(27)13-28-19-7-3-2-6-17(19)22)8-9-18(16)25-21(23-14)26-10-4-5-11-26/h2-3,6-9,12H,4-5,10-11,13H2,1H3,(H,24,27)
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n/an/a 1.93E+3n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Displacement of 125I-[Phe13,Tyr19]-MCH from MCH-R1 expressing cell membranes


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (human))
BDBM50150057
PNG
(2-(4-Chloro-phenoxy)-N-[4-methyl-2-(4-methyl-piper...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C23H25ClN4O2/c1-16-13-22(28-11-9-27(2)10-12-28)26-21-8-5-18(14-20(16)21)25-23(29)15-30-19-6-3-17(24)4-7-19/h3-8,13-14H,9-12,15H2,1-2H3,(H,25,29)
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n/an/a 2.18E+3n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibitory activity against human 5-HT2A receptor


Bioorg Med Chem Lett 14: 4099-102 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.051
BindingDB Entry DOI: 10.7270/Q2WW7H49
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50200788
PNG
(2-(4-chlorophenoxy)-N-(4-methyl-2-(pyrrolidin-1-yl...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-18-12-16(24-20(27)13-28-17-7-4-15(22)5-8-17)6-9-19(18)25-21(23-14)26-10-2-3-11-26/h4-9,12H,2-3,10-11,13H2,1H3,(H,24,27)
PDB
MMDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of hERG in patch-clamp assay


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
GPR145


(HUMAN)
BDBM50241099
PNG
(ADS-103274 | CHEMBL276393 | N-(2-((2-(dimethylamin...)
Show SMILES CN(C)CCN(C)c1nc2ccc(NC(=O)COc3ccc(cc3)C(F)(F)F)cc2n1C
Show InChI InChI=1S/C22H26F3N5O2/c1-28(2)11-12-29(3)21-27-18-10-7-16(13-19(18)30(21)4)26-20(31)14-32-17-8-5-15(6-9-17)22(23,24)25/h5-10,13H,11-12,14H2,1-4H3,(H,26,31)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of MCH-R2


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50200788
PNG
(2-(4-chlorophenoxy)-N-(4-methyl-2-(pyrrolidin-1-yl...)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCCC1
Show InChI InChI=1S/C21H21ClN4O2/c1-14-18-12-16(24-20(27)13-28-17-7-4-15(22)5-8-17)6-9-19(18)25-21(23-14)26-10-2-3-11-26/h4-9,12H,2-3,10-11,13H2,1H3,(H,24,27)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Argenta Discovery Limited

Curated by ChEMBL


Assay Description
Inhibition of D2(L)


Bioorg Med Chem Lett 17: 1403-7 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.092
BindingDB Entry DOI: 10.7270/Q2G73DCD
More data for this
Ligand-Target Pair