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Compile Data Set for Download or QSAR

Found 102 hits Enz. Inhib. hit(s) with all data for entry = 50039641   
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
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381374
PNG
(CHEMBL2016724)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)C(=O)NC1CC1
Show InChI InChI=1S/C27H28F3N5O4/c1-16-22-14-19(32-24(36)15-38-20-5-7-21(8-6-20)39-27(28,29)30)4-9-23(22)34-26(31-16)35-12-10-17(11-13-35)25(37)33-18-2-3-18/h4-9,14,17-18H,2-3,10-13,15H2,1H3,(H,32,36)(H,33,37)
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n/an/a 3n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381379
PNG
(CHEMBL2016730)
Show SMILES CC(C)NC(=O)NC1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C26H31ClN6O3/c1-16(2)28-26(35)31-19-10-12-33(13-11-19)25-29-17(3)22-14-20(6-9-23(22)32-25)30-24(34)15-36-21-7-4-18(27)5-8-21/h4-9,14,16,19H,10-13,15H2,1-3H3,(H,30,34)(H2,28,31,35)
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n/an/a 4n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381362
PNG
(CHEMBL2016776)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)N1CCCC1=O
Show InChI InChI=1S/C27H28F3N5O4/c1-17-22-15-18(32-24(36)16-38-20-5-7-21(8-6-20)39-27(28,29)30)4-9-23(22)33-26(31-17)34-13-10-19(11-14-34)35-12-2-3-25(35)37/h4-9,15,19H,2-3,10-14,16H2,1H3,(H,32,36)
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n/an/a 4n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381383
PNG
(CHEMBL2016775)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)N1CCOCC1
Show InChI InChI=1S/C27H30F3N5O4/c1-18-23-16-19(32-25(36)17-38-21-3-5-22(6-4-21)39-27(28,29)30)2-7-24(23)33-26(31-18)35-10-8-20(9-11-35)34-12-14-37-15-13-34/h2-7,16,20H,8-15,17H2,1H3,(H,32,36)
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n/an/a 6n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381343
PNG
(CHEMBL2016704)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCN(CC1)C1CCOCC1
Show InChI InChI=1S/C27H30F3N5O4/c1-18-23-16-19(32-25(36)17-38-21-3-5-22(6-4-21)39-27(28,29)30)2-7-24(23)33-26(31-18)35-12-10-34(11-13-35)20-8-14-37-15-9-20/h2-7,16,20H,8-15,17H2,1H3,(H,32,36)
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n/an/a 7n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381379
PNG
(CHEMBL2016730)
Show SMILES CC(C)NC(=O)NC1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C26H31ClN6O3/c1-16(2)28-26(35)31-19-10-12-33(13-11-19)25-29-17(3)22-14-20(6-9-23(22)32-25)30-24(34)15-36-21-7-4-18(27)5-8-21/h4-9,14,16,19H,10-13,15H2,1-3H3,(H,30,34)(H2,28,31,35)
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n/an/a 7n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381360
PNG
(CHEMBL2016722)
Show SMILES CC(C)NC(=O)C1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C27H30F3N5O4/c1-16(2)31-25(37)18-10-12-35(13-11-18)26-32-17(3)22-14-19(4-9-23(22)34-26)33-24(36)15-38-20-5-7-21(8-6-20)39-27(28,29)30/h4-9,14,16,18H,10-13,15H2,1-3H3,(H,31,37)(H,33,36)
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n/an/a 9n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381374
PNG
(CHEMBL2016724)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)C(=O)NC1CC1
Show InChI InChI=1S/C27H28F3N5O4/c1-16-22-14-19(32-24(36)15-38-20-5-7-21(8-6-20)39-27(28,29)30)4-9-23(22)34-26(31-16)35-12-10-17(11-13-35)25(37)33-18-2-3-18/h4-9,14,17-18H,2-3,10-13,15H2,1H3,(H,32,36)(H,33,37)
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n/an/a 9n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381375
PNG
(CHEMBL2016726)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)C(=O)C1CC1
Show InChI InChI=1S/C27H27F3N4O4/c1-16-22-14-19(32-24(35)15-37-20-5-7-21(8-6-20)38-27(28,29)30)4-9-23(22)33-26(31-16)34-12-10-18(11-13-34)25(36)17-2-3-17/h4-9,14,17-18H,2-3,10-13,15H2,1H3,(H,32,35)
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n/an/a 10n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381375
PNG
(CHEMBL2016726)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)C(=O)C1CC1
Show InChI InChI=1S/C27H27F3N4O4/c1-16-22-14-19(32-24(35)15-37-20-5-7-21(8-6-20)38-27(28,29)30)4-9-23(22)33-26(31-16)34-12-10-18(11-13-34)25(36)17-2-3-17/h4-9,14,17-18H,2-3,10-13,15H2,1H3,(H,32,35)
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n/an/a 14n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381378
PNG
(CHEMBL2016729)
Show SMILES CC(C)C(=O)NC1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C26H30ClN5O3/c1-16(2)25(34)30-19-10-12-32(13-11-19)26-28-17(3)22-14-20(6-9-23(22)31-26)29-24(33)15-35-21-7-4-18(27)5-8-21/h4-9,14,16,19H,10-13,15H2,1-3H3,(H,29,33)(H,30,34)
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n/an/a 15n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381371
PNG
(CHEMBL2016721)
Show SMILES CC(C)NC(=O)C1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C26H30ClN5O3/c1-16(2)28-25(34)18-10-12-32(13-11-18)26-29-17(3)22-14-20(6-9-23(22)31-26)30-24(33)15-35-21-7-4-19(27)5-8-21/h4-9,14,16,18H,10-13,15H2,1-3H3,(H,28,34)(H,30,33)
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n/an/a 15n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381383
PNG
(CHEMBL2016775)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)N1CCOCC1
Show InChI InChI=1S/C27H30F3N5O4/c1-18-23-16-19(32-25(36)17-38-21-3-5-22(6-4-21)39-27(28,29)30)2-7-24(23)33-26(31-18)35-10-8-20(9-11-35)34-12-14-37-15-13-34/h2-7,16,20H,8-15,17H2,1H3,(H,32,36)
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n/an/a 16n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381360
PNG
(CHEMBL2016722)
Show SMILES CC(C)NC(=O)C1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C27H30F3N5O4/c1-16(2)31-25(37)18-10-12-35(13-11-18)26-32-17(3)22-14-19(4-9-23(22)34-26)33-24(36)15-38-20-5-7-21(8-6-20)39-27(28,29)30/h4-9,14,16,18H,10-13,15H2,1-3H3,(H,31,37)(H,33,36)
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n/an/a 17n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381373
PNG
(CHEMBL2016723)
Show SMILES CN(C)C(=O)C1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C26H28F3N5O4/c1-16-21-14-18(31-23(35)15-37-19-5-7-20(8-6-19)38-26(27,28)29)4-9-22(21)32-25(30-16)34-12-10-17(11-13-34)24(36)33(2)3/h4-9,14,17H,10-13,15H2,1-3H3,(H,31,35)
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n/an/a 18n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381362
PNG
(CHEMBL2016776)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)N1CCCC1=O
Show InChI InChI=1S/C27H28F3N5O4/c1-17-22-15-18(32-24(36)16-38-20-5-7-21(8-6-20)39-27(28,29)30)4-9-23(22)33-26(31-17)34-13-10-19(11-14-34)35-12-2-3-25(35)37/h4-9,15,19H,2-3,10-14,16H2,1H3,(H,32,36)
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n/an/a 19n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381361
PNG
(CHEMBL2016731)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H30ClN5O2/c1-18-23-16-20(29-25(33)17-34-22-7-4-19(27)5-8-22)6-9-24(23)30-26(28-18)32-14-10-21(11-15-32)31-12-2-3-13-31/h4-9,16,21H,2-3,10-15,17H2,1H3,(H,29,33)
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n/an/a 20n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381377
PNG
(CHEMBL2016728)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(N)CC1
Show InChI InChI=1S/C23H24F3N5O3/c1-14-19-12-16(2-7-20(19)30-22(28-14)31-10-8-15(27)9-11-31)29-21(32)13-33-17-3-5-18(6-4-17)34-23(24,25)26/h2-7,12,15H,8-11,13,27H2,1H3,(H,29,32)
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n/an/a 22n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381363
PNG
(CHEMBL2016725)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)C(N)=O
Show InChI InChI=1S/C24H24F3N5O4/c1-14-19-12-16(30-21(33)13-35-17-3-5-18(6-4-17)36-24(25,26)27)2-7-20(19)31-23(29-14)32-10-8-15(9-11-32)22(28)34/h2-7,12,15H,8-11,13H2,1H3,(H2,28,34)(H,30,33)
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n/an/a 23n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381371
PNG
(CHEMBL2016721)
Show SMILES CC(C)NC(=O)C1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C26H30ClN5O3/c1-16(2)28-25(34)18-10-12-32(13-11-18)26-29-17(3)22-14-20(6-9-23(22)31-26)30-24(33)15-35-21-7-4-19(27)5-8-21/h4-9,14,16,18H,10-13,15H2,1-3H3,(H,28,34)(H,30,33)
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n/an/a 25n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381365
PNG
(CHEMBL2016781)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)C1CCC1
Show InChI InChI=1S/C27H29F3N4O4/c1-17-22-15-19(32-24(35)16-37-20-6-8-21(9-7-20)38-27(28,29)30)5-10-23(22)33-25(31-17)34-13-11-26(36,12-14-34)18-3-2-4-18/h5-10,15,18,36H,2-4,11-14,16H2,1H3,(H,32,35)
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n/an/a 27n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381350
PNG
(CHEMBL2016711)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCN(CC1)C(=O)C1CC1
Show InChI InChI=1S/C26H26F3N5O4/c1-16-21-14-18(31-23(35)15-37-19-5-7-20(8-6-19)38-26(27,28)29)4-9-22(21)32-25(30-16)34-12-10-33(11-13-34)24(36)17-2-3-17/h4-9,14,17H,2-3,10-13,15H2,1H3,(H,31,35)
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n/an/a 30n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381382
PNG
(CHEMBL2016774)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C27H30F3N5O3/c1-18-23-16-19(32-25(36)17-37-21-5-7-22(8-6-21)38-27(28,29)30)4-9-24(23)33-26(31-18)35-14-10-20(11-15-35)34-12-2-3-13-34/h4-9,16,20H,2-3,10-15,17H2,1H3,(H,32,36)
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n/an/a 31n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381343
PNG
(CHEMBL2016704)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCN(CC1)C1CCOCC1
Show InChI InChI=1S/C27H30F3N5O4/c1-18-23-16-19(32-25(36)17-38-21-3-5-22(6-4-21)39-27(28,29)30)2-7-24(23)33-26(31-18)35-12-10-34(11-13-35)20-8-14-37-15-9-20/h2-7,16,20H,8-15,17H2,1H3,(H,32,36)
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n/an/a 31n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381363
PNG
(CHEMBL2016725)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(CC1)C(N)=O
Show InChI InChI=1S/C24H24F3N5O4/c1-14-19-12-16(30-21(33)13-35-17-3-5-18(6-4-17)36-24(25,26)27)2-7-20(19)31-23(29-14)32-10-8-15(9-11-32)22(28)34/h2-7,12,15H,8-11,13H2,1H3,(H2,28,34)(H,30,33)
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n/an/a 32n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381386
PNG
(CHEMBL2016780)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)C1CC1
Show InChI InChI=1S/C26H27F3N4O4/c1-16-21-14-18(31-23(34)15-36-19-5-7-20(8-6-19)37-26(27,28)29)4-9-22(21)32-24(30-16)33-12-10-25(35,11-13-33)17-2-3-17/h4-9,14,17,35H,2-3,10-13,15H2,1H3,(H,31,34)
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n/an/a 33n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381346
PNG
(CHEMBL2016707)
Show SMILES CC(C)C(=O)N1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C26H28F3N5O4/c1-16(2)24(36)33-10-12-34(13-11-33)25-30-17(3)21-14-18(4-9-22(21)32-25)31-23(35)15-37-19-5-7-20(8-6-19)38-26(27,28)29/h4-9,14,16H,10-13,15H2,1-3H3,(H,31,35)
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n/an/a 33n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381346
PNG
(CHEMBL2016707)
Show SMILES CC(C)C(=O)N1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C26H28F3N5O4/c1-16(2)24(36)33-10-12-34(13-11-33)25-30-17(3)21-14-18(4-9-22(21)32-25)31-23(35)15-37-19-5-7-20(8-6-19)38-26(27,28)29/h4-9,14,16H,10-13,15H2,1-3H3,(H,31,35)
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n/an/a 36n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381352
PNG
(CHEMBL2016713)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCN(CC1)C(=O)C1CCC1
Show InChI InChI=1S/C27H28F3N5O4/c1-17-22-15-19(32-24(36)16-38-20-6-8-21(9-7-20)39-27(28,29)30)5-10-23(22)33-26(31-17)35-13-11-34(12-14-35)25(37)18-3-2-4-18/h5-10,15,18H,2-4,11-14,16H2,1H3,(H,32,36)
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n/an/a 45n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381342
PNG
(CHEMBL2016703)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCN(CC1)C1CCOCC1
Show InChI InChI=1S/C26H30ClN5O3/c1-18-23-16-20(29-25(33)17-35-22-5-2-19(27)3-6-22)4-7-24(23)30-26(28-18)32-12-10-31(11-13-32)21-8-14-34-15-9-21/h2-7,16,21H,8-15,17H2,1H3,(H,29,33)
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n/an/a 45n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381373
PNG
(CHEMBL2016723)
Show SMILES CN(C)C(=O)C1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C26H28F3N5O4/c1-16-21-14-18(31-23(35)15-37-19-5-7-20(8-6-19)38-26(27,28)29)4-9-22(21)32-25(30-16)34-12-10-17(11-13-34)24(36)33(2)3/h4-9,14,17H,10-13,15H2,1-3H3,(H,31,35)
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n/an/a 47n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381350
PNG
(CHEMBL2016711)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCN(CC1)C(=O)C1CC1
Show InChI InChI=1S/C26H26F3N5O4/c1-16-21-14-18(31-23(35)15-37-19-5-7-20(8-6-19)38-26(27,28)29)4-9-22(21)32-25(30-16)34-12-10-33(11-13-34)24(36)17-2-3-17/h4-9,14,17H,2-3,10-13,15H2,1H3,(H,31,35)
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n/an/a 49n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50150073
PNG
(CHEMBL184084 | N-(4-methyl-2-(4-methylpiperazin-1-...)
Show SMILES CN1CCN(CC1)c1cc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C24H25F3N4O3/c1-16-13-22(31-11-9-30(2)10-12-31)29-21-8-3-17(14-20(16)21)28-23(32)15-33-18-4-6-19(7-5-18)34-24(25,26)27/h3-8,13-14H,9-12,15H2,1-2H3,(H,28,32)
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n/an/a 50n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50172424
PNG
(CHEMBL198361 | N-(4-Methyl-2-morpholin-4-yl-quinol...)
Show SMILES Cc1cc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCOCC1
Show InChI InChI=1S/C23H22F3N3O4/c1-15-12-21(29-8-10-31-11-9-29)28-20-7-2-16(13-19(15)20)27-22(30)14-32-17-3-5-18(6-4-17)33-23(24,25)26/h2-7,12-13H,8-11,14H2,1H3,(H,27,30)
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n/an/a 50n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381378
PNG
(CHEMBL2016729)
Show SMILES CC(C)C(=O)NC1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C26H30ClN5O3/c1-16(2)25(34)30-19-10-12-32(13-11-19)26-28-17(3)22-14-20(6-9-23(22)31-26)29-24(33)15-35-21-7-4-18(27)5-8-21/h4-9,14,16,19H,10-13,15H2,1-3H3,(H,29,33)(H,30,34)
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n/an/a 54n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381368
PNG
(CHEMBL2016784)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)c1ccc(F)cc1
Show InChI InChI=1S/C29H26F4N4O4/c1-18-24-16-21(35-26(38)17-40-22-7-9-23(10-8-22)41-29(31,32)33)6-11-25(24)36-27(34-18)37-14-12-28(39,13-15-37)19-2-4-20(30)5-3-19/h2-11,16,39H,12-15,17H2,1H3,(H,35,38)
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n/an/a 55n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381369
PNG
(CHEMBL2016786)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)c1ccc(F)cn1
Show InChI InChI=1S/C28H25F4N5O4/c1-17-22-14-19(35-25(38)16-40-20-4-6-21(7-5-20)41-28(30,31)32)3-8-23(22)36-26(34-17)37-12-10-27(39,11-13-37)24-9-2-18(29)15-33-24/h2-9,14-15,39H,10-13,16H2,1H3,(H,35,38)
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n/an/a 59n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381385
PNG
(CHEMBL2016779)
Show SMILES CCC1(O)CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C25H27F3N4O4/c1-3-24(34)10-12-32(13-11-24)23-29-16(2)20-14-17(4-9-21(20)31-23)30-22(33)15-35-18-5-7-19(8-6-18)36-25(26,27)28/h4-9,14,34H,3,10-13,15H2,1-2H3,(H,30,33)
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n/an/a 59n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381367
PNG
(CHEMBL2016783)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)c1ccccc1
Show InChI InChI=1S/C29H27F3N4O4/c1-19-24-17-21(34-26(37)18-39-22-8-10-23(11-9-22)40-29(30,31)32)7-12-25(24)35-27(33-19)36-15-13-28(38,14-16-36)20-5-3-2-4-6-20/h2-12,17,38H,13-16,18H2,1H3,(H,34,37)
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n/an/a 67n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381365
PNG
(CHEMBL2016781)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)C1CCC1
Show InChI InChI=1S/C27H29F3N4O4/c1-17-22-15-19(32-24(35)16-37-20-6-8-21(9-7-20)38-27(28,29)30)5-10-23(22)33-25(31-17)34-13-11-26(36,12-14-34)18-3-2-4-18/h5-10,15,18,36H,2-4,11-14,16H2,1H3,(H,32,35)
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n/an/a 79n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381377
PNG
(CHEMBL2016728)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(N)CC1
Show InChI InChI=1S/C23H24F3N5O3/c1-14-19-12-16(2-7-20(19)30-22(28-14)31-10-8-15(27)9-11-31)29-21(32)13-33-17-3-5-18(6-4-17)34-23(24,25)26/h2-7,12,15H,8-11,13,27H2,1H3,(H,29,32)
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n/an/a 80n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381361
PNG
(CHEMBL2016731)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCC(CC1)N1CCCC1
Show InChI InChI=1S/C26H30ClN5O2/c1-18-23-16-20(29-25(33)17-34-22-7-4-19(27)5-8-22)6-9-24(23)30-26(28-18)32-14-10-21(11-15-32)31-12-2-3-13-31/h4-9,16,21H,2-3,10-15,17H2,1H3,(H,29,33)
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n/an/a 81n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381352
PNG
(CHEMBL2016713)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCN(CC1)C(=O)C1CCC1
Show InChI InChI=1S/C27H28F3N5O4/c1-17-22-15-19(32-24(36)16-38-20-6-8-21(9-7-20)39-27(28,29)30)5-10-23(22)33-26(31-17)35-13-11-34(12-14-35)25(37)18-3-2-4-18/h5-10,15,18H,2-4,11-14,16H2,1H3,(H,32,36)
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n/an/a 84n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381345
PNG
(CHEMBL2016706)
Show SMILES CC(C)C(=O)N1CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(Cl)cc3)ccc2n1
Show InChI InChI=1S/C25H28ClN5O3/c1-16(2)24(33)30-10-12-31(13-11-30)25-27-17(3)21-14-19(6-9-22(21)29-25)28-23(32)15-34-20-7-4-18(26)5-8-20/h4-9,14,16H,10-13,15H2,1-3H3,(H,28,32)
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n/an/a 91n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381341
PNG
(CHEMBL2016702)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCN(CC1)C1CCCC1
Show InChI InChI=1S/C26H30ClN5O2/c1-18-23-16-20(29-25(33)17-34-22-9-6-19(27)7-10-22)8-11-24(23)30-26(28-18)32-14-12-31(13-15-32)21-4-2-3-5-21/h6-11,16,21H,2-5,12-15,17H2,1H3,(H,29,33)
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n/an/a 96n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381364
PNG
(CHEMBL2016785)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)c1cccc(F)c1
Show InChI InChI=1S/C29H26F4N4O4/c1-18-24-16-21(35-26(38)17-40-22-6-8-23(9-7-22)41-29(31,32)33)5-10-25(24)36-27(34-18)37-13-11-28(39,12-14-37)19-3-2-4-20(30)15-19/h2-10,15-16,39H,11-14,17H2,1H3,(H,35,38)
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n/an/a 100n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381386
PNG
(CHEMBL2016780)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(OC(F)(F)F)cc3)cc12)N1CCC(O)(CC1)C1CC1
Show InChI InChI=1S/C26H27F3N4O4/c1-16-21-14-18(31-23(34)15-36-19-5-7-20(8-6-19)37-26(27,28)29)4-9-22(21)32-24(30-16)33-12-10-25(35,11-13-33)17-2-3-17/h4-9,14,17,35H,2-3,10-13,15H2,1H3,(H,31,34)
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n/an/a 101n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381342
PNG
(CHEMBL2016703)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCN(CC1)C1CCOCC1
Show InChI InChI=1S/C26H30ClN5O3/c1-18-23-16-20(29-25(33)17-35-22-5-2-19(27)3-6-22)4-7-24(23)30-26(28-18)32-12-10-31(11-13-32)21-8-14-34-15-9-21/h2-7,16,21H,8-15,17H2,1H3,(H,29,33)
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n/an/a 115n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human MCHR1 expressed in CHO-K1 cells assessed as inhibition of MCH peptide mediated response measuring [3H]inositol phosphate...


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381354
PNG
(CHEMBL2016715)
Show SMILES Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCN(CC1)C(=O)C1CCCCC1
Show InChI InChI=1S/C28H32ClN5O3/c1-19-24-17-22(31-26(35)18-37-23-10-7-21(29)8-11-23)9-12-25(24)32-28(30-19)34-15-13-33(14-16-34)27(36)20-5-3-2-4-6-20/h7-12,17,20H,2-6,13-16,18H2,1H3,(H,31,35)
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n/an/a 116n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50381385
PNG
(CHEMBL2016779)
Show SMILES CCC1(O)CCN(CC1)c1nc(C)c2cc(NC(=O)COc3ccc(OC(F)(F)F)cc3)ccc2n1
Show InChI InChI=1S/C25H27F3N4O4/c1-3-24(34)10-12-32(13-11-24)23-29-16(2)20-14-17(4-9-21(20)31-23)30-22(33)15-35-18-5-7-19(8-6-18)36-25(26,27)28/h4-9,14,34H,3,10-13,15H2,1-2H3,(H,30,33)
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n/an/a 116n/an/an/an/an/an/a



Dr. Reddy's Laboratories Ltd

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human recombinant MCHR1 expressed in CHO-K1 cell membranes after 2 hrs by SPA binding assay


Bioorg Med Chem Lett 22: 3157-62 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.050
BindingDB Entry DOI: 10.7270/Q2D79CFJ
More data for this
Ligand-Target Pair
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