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Compile Data Set for Download or QSAR

Found 29 hits Enz. Inhib. hit(s) with all data for entry = 50016773   
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))
BDBM50173461
PNG
(4-(1-Benzo[1,3]dioxol-5-ylmethyl-piperidin-4-ylami...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCOc5c4)CC3)c2c1
Show InChI InChI=1S/C22H21ClN2O4/c23-15-2-4-19-17(10-15)18(11-22(26)29-19)24-16-5-7-25(8-6-16)12-14-1-3-20-21(9-14)28-13-27-20/h1-4,9-11,16,24H,5-8,12-13H2
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n/an/a 2n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173454
PNG
(4-(1-Benzooxazol-5-ylmethyl-piperidin-4-ylamino)-6...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5ocnc5c4)CC3)c2c1
Show InChI InChI=1S/C22H20ClN3O3/c23-15-2-4-20-17(10-15)18(11-22(27)29-20)25-16-5-7-26(8-6-16)12-14-1-3-21-19(9-14)24-13-28-21/h1-4,9-11,13,16,25H,5-8,12H2
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n/an/a 3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173465
PNG
(6-Methoxy-4-[1-(3-phenyl-allyl)-piperidin-4-ylamin...)
Show SMILES COc1ccc2oc(=O)cc(NC3CCN(C\C=C\c4ccccc4)CC3)c2c1
Show InChI InChI=1S/C24H26N2O3/c1-28-20-9-10-23-21(16-20)22(17-24(27)29-23)25-19-11-14-26(15-12-19)13-5-8-18-6-3-2-4-7-18/h2-10,16-17,19,25H,11-15H2,1H3/b8-5+
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n/an/a 4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173452
PNG
(4-(1-Benzo[b]thiophen-5-ylmethyl-piperidin-4-ylami...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5sccc5c4)CC3)c2c1
Show InChI InChI=1S/C23H21ClN2O2S/c24-17-2-3-21-19(12-17)20(13-23(27)28-21)25-18-5-8-26(9-6-18)14-15-1-4-22-16(11-15)7-10-29-22/h1-4,7,10-13,18,25H,5-6,8-9,14H2
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n/an/a 6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173459
PNG
(6-Chloro-4-[1-(1H-indol-5-ylmethyl)-piperidin-4-yl...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5[nH]ccc5c4)CC3)c2c1
Show InChI InChI=1S/C23H22ClN3O2/c24-17-2-4-22-19(12-17)21(13-23(28)29-22)26-18-6-9-27(10-7-18)14-15-1-3-20-16(11-15)5-8-25-20/h1-5,8,11-13,18,25-26H,6-7,9-10,14H2
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n/an/a 7n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173464
PNG
(6-Chloro-4-[1-(3-phenyl-allyl)-piperidin-4-ylamino...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(C\C=C\c4ccccc4)CC3)c2c1
Show InChI InChI=1S/C23H23ClN2O2/c24-18-8-9-22-20(15-18)21(16-23(27)28-22)25-19-10-13-26(14-11-19)12-4-7-17-5-2-1-3-6-17/h1-9,15-16,19,25H,10-14H2/b7-4+
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n/an/a 9n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173460
PNG
(4-(1-(benzo[d][1,3]dioxol-5-ylmethyl)piperidin-4-y...)
Show SMILES COc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCOc5c4)CC3)c2c1
Show InChI InChI=1S/C23H24N2O5/c1-27-17-3-5-20-18(11-17)19(12-23(26)30-20)24-16-6-8-25(9-7-16)13-15-2-4-21-22(10-15)29-14-28-21/h2-5,10-12,16,24H,6-9,13-14H2,1H3
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n/an/a 11n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173453
PNG
(6-Chloro-4-[1-(2,2-difluoro-benzo[1,3]dioxol-5-ylm...)
Show SMILES FC1(F)Oc2ccc(CN3CCC(CC3)Nc3cc(=O)oc4ccc(Cl)cc34)cc2O1
Show InChI InChI=1S/C22H19ClF2N2O4/c23-14-2-4-18-16(10-14)17(11-21(28)29-18)26-15-5-7-27(8-6-15)12-13-1-3-19-20(9-13)31-22(24,25)30-19/h1-4,9-11,15,26H,5-8,12H2
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n/an/a 19n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173458
PNG
(6-Chloro-4-(1-naphthalen-2-ylmethyl-piperidin-4-yl...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5ccccc5c4)CC3)c2c1
Show InChI InChI=1S/C25H23ClN2O2/c26-20-7-8-24-22(14-20)23(15-25(29)30-24)27-21-9-11-28(12-10-21)16-17-5-6-18-3-1-2-4-19(18)13-17/h1-8,13-15,21,27H,9-12,16H2
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n/an/a 21n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173456
PNG
(6-Chloro-4-[1-(1H-indol-6-ylmethyl)-piperidin-4-yl...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5cc[nH]c5c4)CC3)c2c1
Show InChI InChI=1S/C23H22ClN3O2/c24-17-3-4-22-19(12-17)21(13-23(28)29-22)26-18-6-9-27(10-7-18)14-15-1-2-16-5-8-25-20(16)11-15/h1-5,8,11-13,18,25-26H,6-7,9-10,14H2
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n/an/a 24n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173462
PNG
(6-Chloro-4-[1-(2,3-dihydro-benzofuran-5-ylmethyl)-...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCCc5c4)CC3)c2c1
Show InChI InChI=1S/C23H23ClN2O3/c24-17-2-4-22-19(12-17)20(13-23(27)29-22)25-18-5-8-26(9-6-18)14-15-1-3-21-16(11-15)7-10-28-21/h1-4,11-13,18,25H,5-10,14H2
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n/an/a 27n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173461
PNG
(4-(1-Benzo[1,3]dioxol-5-ylmethyl-piperidin-4-ylami...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCOc5c4)CC3)c2c1
Show InChI InChI=1S/C22H21ClN2O4/c23-15-2-4-19-17(10-15)18(11-22(26)29-19)24-16-5-7-25(8-6-16)12-14-1-3-20-21(9-14)28-13-27-20/h1-4,9-11,16,24H,5-8,12-13H2
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n/an/a 28n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173456
PNG
(6-Chloro-4-[1-(1H-indol-6-ylmethyl)-piperidin-4-yl...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5cc[nH]c5c4)CC3)c2c1
Show InChI InChI=1S/C23H22ClN3O2/c24-17-3-4-22-19(12-17)21(13-23(28)29-22)26-18-6-9-27(10-7-18)14-15-1-2-16-5-8-25-20(16)11-15/h1-5,8,11-13,18,25-26H,6-7,9-10,14H2
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n/an/a 28n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173462
PNG
(6-Chloro-4-[1-(2,3-dihydro-benzofuran-5-ylmethyl)-...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCCc5c4)CC3)c2c1
Show InChI InChI=1S/C23H23ClN2O3/c24-17-2-4-22-19(12-17)20(13-23(27)29-22)25-18-5-8-26(9-6-18)14-15-1-3-21-16(11-15)7-10-28-21/h1-4,11-13,18,25H,5-10,14H2
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n/an/a 41n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173465
PNG
(6-Methoxy-4-[1-(3-phenyl-allyl)-piperidin-4-ylamin...)
Show SMILES COc1ccc2oc(=O)cc(NC3CCN(C\C=C\c4ccccc4)CC3)c2c1
Show InChI InChI=1S/C24H26N2O3/c1-28-20-9-10-23-21(16-20)22(17-24(27)29-23)25-19-11-14-26(15-12-19)13-5-8-18-6-3-2-4-7-18/h2-10,16-17,19,25H,11-15H2,1H3/b8-5+
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n/an/a 44n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173455
PNG
(6-Chloro-4-[1-(1-methyl-1H-indol-6-ylmethyl)-piper...)
Show SMILES Cn1ccc2ccc(CN3CCC(CC3)Nc3cc(=O)oc4ccc(Cl)cc34)cc12
Show InChI InChI=1S/C24H24ClN3O2/c1-27-9-6-17-3-2-16(12-22(17)27)15-28-10-7-19(8-11-28)26-21-14-24(29)30-23-5-4-18(25)13-20(21)23/h2-6,9,12-14,19,26H,7-8,10-11,15H2,1H3
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n/an/a 60n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173459
PNG
(6-Chloro-4-[1-(1H-indol-5-ylmethyl)-piperidin-4-yl...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5[nH]ccc5c4)CC3)c2c1
Show InChI InChI=1S/C23H22ClN3O2/c24-17-2-4-22-19(12-17)21(13-23(28)29-22)26-18-6-9-27(10-7-18)14-15-1-3-20-16(11-15)5-8-25-20/h1-5,8,11-13,18,25-26H,6-7,9-10,14H2
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n/an/a 63n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173463
PNG
(4-(1-Benzooxazol-6-ylmethyl-piperidin-4-ylamino)-6...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5ncoc5c4)CC3)c2c1
Show InChI InChI=1S/C22H20ClN3O3/c23-15-2-4-20-17(10-15)19(11-22(27)29-20)25-16-5-7-26(8-6-16)12-14-1-3-18-21(9-14)28-13-24-18/h1-4,9-11,13,16,25H,5-8,12H2
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n/an/a 75n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173458
PNG
(6-Chloro-4-(1-naphthalen-2-ylmethyl-piperidin-4-yl...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5ccccc5c4)CC3)c2c1
Show InChI InChI=1S/C25H23ClN2O2/c26-20-7-8-24-22(14-20)23(15-25(29)30-24)27-21-9-11-28(12-10-21)16-17-5-6-18-3-1-2-4-19(18)13-17/h1-8,13-15,21,27H,9-12,16H2
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173455
PNG
(6-Chloro-4-[1-(1-methyl-1H-indol-6-ylmethyl)-piper...)
Show SMILES Cn1ccc2ccc(CN3CCC(CC3)Nc3cc(=O)oc4ccc(Cl)cc34)cc12
Show InChI InChI=1S/C24H24ClN3O2/c1-27-9-6-17-3-2-16(12-22(17)27)15-28-10-7-19(8-11-28)26-21-14-24(29)30-23-5-4-18(25)13-20(21)23/h2-6,9,12-14,19,26H,7-8,10-11,15H2,1H3
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n/an/a 162n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173454
PNG
(4-(1-Benzooxazol-5-ylmethyl-piperidin-4-ylamino)-6...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5ocnc5c4)CC3)c2c1
Show InChI InChI=1S/C22H20ClN3O3/c23-15-2-4-20-17(10-15)18(11-22(27)29-20)25-16-5-7-26(8-6-16)12-14-1-3-21-19(9-14)24-13-28-21/h1-4,9-11,13,16,25H,5-8,12H2
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n/an/a 163n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173452
PNG
(4-(1-Benzo[b]thiophen-5-ylmethyl-piperidin-4-ylami...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5sccc5c4)CC3)c2c1
Show InChI InChI=1S/C23H21ClN2O2S/c24-17-2-3-21-19(12-17)20(13-23(27)28-21)25-18-5-8-26(9-6-18)14-15-1-4-22-16(11-15)7-10-29-22/h1-4,7,10-13,18,25H,5-6,8-9,14H2
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n/an/a 189n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173457
PNG
(4-{1-[((E)-3-Phenyl)-allyl]-piperidin-4-ylamino}-c...)
Show SMILES O=c1cc(NC2CCN(C\C=C\c3ccccc3)CC2)c2ccccc2o1
Show InChI InChI=1S/C23H24N2O2/c26-23-17-21(20-10-4-5-11-22(20)27-23)24-19-12-15-25(16-13-19)14-6-9-18-7-2-1-3-8-18/h1-11,17,19,24H,12-16H2/b9-6+
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n/an/a 191n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration aganist melanin concentrating hormone receptor 1 expressed in IMR-32 cells using [125I]-MCH


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173464
PNG
(6-Chloro-4-[1-(3-phenyl-allyl)-piperidin-4-ylamino...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(C\C=C\c4ccccc4)CC3)c2c1
Show InChI InChI=1S/C23H23ClN2O2/c24-18-8-9-22-20(15-18)21(16-23(27)28-22)25-19-10-13-26(14-11-19)12-4-7-17-5-2-1-3-6-17/h1-9,15-16,19,25H,10-14H2/b7-4+
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n/an/a 211n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173463
PNG
(4-(1-Benzooxazol-6-ylmethyl-piperidin-4-ylamino)-6...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5ncoc5c4)CC3)c2c1
Show InChI InChI=1S/C22H20ClN3O3/c23-15-2-4-20-17(10-15)19(11-22(27)29-20)25-16-5-7-26(8-6-16)12-14-1-3-18-21(9-14)28-13-24-18/h1-4,9-11,13,16,25H,5-8,12H2
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n/an/a 461n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173453
PNG
(6-Chloro-4-[1-(2,2-difluoro-benzo[1,3]dioxol-5-ylm...)
Show SMILES FC1(F)Oc2ccc(CN3CCC(CC3)Nc3cc(=O)oc4ccc(Cl)cc34)cc2O1
Show InChI InChI=1S/C22H19ClF2N2O4/c23-14-2-4-18-16(10-14)17(11-21(28)29-18)26-15-5-7-27(8-6-15)12-13-1-3-19-20(9-13)31-22(24,25)30-19/h1-4,9-11,15,26H,5-8,12H2
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n/an/a 581n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173457
PNG
(4-{1-[((E)-3-Phenyl)-allyl]-piperidin-4-ylamino}-c...)
Show SMILES O=c1cc(NC2CCN(C\C=C\c3ccccc3)CC2)c2ccccc2o1
Show InChI InChI=1S/C23H24N2O2/c26-23-17-21(20-10-4-5-11-22(20)27-23)24-19-12-15-25(16-13-19)14-6-9-18-7-2-1-3-8-18/h1-11,17,19,24H,12-16H2/b9-6+
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n/an/a 1.04E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50173461
PNG
(4-(1-Benzo[1,3]dioxol-5-ylmethyl-piperidin-4-ylami...)
Show SMILES Clc1ccc2oc(=O)cc(NC3CCN(Cc4ccc5OCOc5c4)CC3)c2c1
Show InChI InChI=1S/C22H21ClN2O4/c23-15-2-4-19-17(10-15)18(11-22(26)29-19)24-16-5-7-25(8-6-16)12-14-1-3-20-21(9-14)28-13-27-20/h1-4,9-11,16,24H,5-8,12-13H2
PDB
MMDB

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n/an/a 2.25E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human potassium channel HERG


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))
BDBM50173466
PNG
(4-[1-(4-tert-Butyl-benzyl)-piperidin-4-ylamino]-6-...)
Show SMILES CC(C)(C)c1ccc(CN2CCC(CC2)Nc2cc(=O)oc3ccc(Cl)cc23)cc1
Show InChI InChI=1S/C25H29ClN2O2/c1-25(2,3)18-6-4-17(5-7-18)16-28-12-10-20(11-13-28)27-22-15-24(29)30-23-9-8-19(26)14-21(22)23/h4-9,14-15,20,27H,10-13,16H2,1-3H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of melanin concentrating hormone receptor 1 mediated [Ca2+] release in IMR-32 cells in Ca+2 release cell assay


J Med Chem 48: 5888-91 (2005)


Article DOI: 10.1021/jm050598r
BindingDB Entry DOI: 10.7270/Q2QJ7GTV
More data for this
Ligand-Target Pair