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PubMed code 15341944

Compile data set for download or QSAR
Found 21 hits of Enzyme Inhibition Constant Data   
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))		BDBM50152494
PNG
(8-[1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-pyrrolid...)
Show SMILES Nc1ccc2cccc(OC3CCN(C3)c3ccc4OC(F)(F)Oc4c3)c2n1
Show InChI InChI=1S/C20H17F2N3O3/c21-20(22)27-15-6-5-13(10-17(15)28-20)25-9-8-14(11-25)26-16-3-1-2-12-4-7-18(23)24-19(12)16/h1-7,10,14H,8-9,11H2,(H2,23,24)
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n/an/a 0.900n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152495
PNG
(8-[(S)-1-(4-tert-Butyl-benzyl)-pyrrolidin-3-yloxy]...)
Show SMILES CC(C)(C)c1ccc(CN2CC[C@@H](C2)Oc2cccc3ccc(N)nc23)cc1
Show InChI InChI=1S/C24H29N3O/c1-24(2,3)19-10-7-17(8-11-19)15-27-14-13-20(16-27)28-21-6-4-5-18-9-12-22(25)26-23(18)21/h4-12,20H,13-16H2,1-3H3,(H2,25,26)/t20-/m0/s1
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n/an/a 1n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152497
PNG
(8-[1-(4-Isobutyl-phenyl)-pyrrolidin-3-yloxy]-quino...)
Show SMILES CC(C)Cc1ccc(cc1)N1CCC(C1)Oc1cccc2ccc(N)nc12
Show InChI InChI=1S/C23H27N3O/c1-16(2)14-17-6-9-19(10-7-17)26-13-12-20(15-26)27-21-5-3-4-18-8-11-22(24)25-23(18)21/h3-11,16,20H,12-15H2,1-2H3,(H2,24,25)
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n/an/a 1.20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152502
PNG
(8-[1-(2-Benzo[1,3]dioxol-5-yl-1-methyl-ethyl)-pyrr...)
Show SMILES CC(Cc1ccc2OCOc2c1)N1CCC(C1)Oc1cccc2ccc(N)nc12
Show InChI InChI=1S/C23H25N3O3/c1-15(11-16-5-7-19-21(12-16)28-14-27-19)26-10-9-18(13-26)29-20-4-2-3-17-6-8-22(24)25-23(17)20/h2-8,12,15,18H,9-11,13-14H2,1H3,(H2,24,25)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152488
PNG
(8-[1-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-pyrrolidi...)
Show SMILES Nc1ccc2cccc(OC3CCN(C3)c3ccc4OCCOc4c3)c2n1
Show InChI InChI=1S/C21H21N3O3/c22-20-7-4-14-2-1-3-18(21(14)23-20)27-16-8-9-24(13-16)15-5-6-17-19(12-15)26-11-10-25-17/h1-7,12,16H,8-11,13H2,(H2,22,23)
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n/an/a 2.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152472
PNG
(CHEMBL182261 | N-[3-(2-Amino-quinolin-8-yloxy)-pro...)
Show SMILES Nc1ccc2cccc(OCCCNC(=O)c3cccc(Cl)c3)c2n1
Show InChI InChI=1S/C19H18ClN3O2/c20-15-6-1-5-14(12-15)19(24)22-10-3-11-25-16-7-2-4-13-8-9-17(21)23-18(13)16/h1-2,4-9,12H,3,10-11H2,(H2,21,23)(H,22,24)
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n/an/a 3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152455
PNG
(8-[3-(4-Chloro-3-trifluoromethyl-benzylamino)-prop...)
Show SMILES Nc1ccc2cccc(OCCCNCc3ccc(Cl)c(c3)C(F)(F)F)c2n1
Show InChI InChI=1S/C20H19ClF3N3O/c21-16-7-5-13(11-15(16)20(22,23)24)12-26-9-2-10-28-17-4-1-3-14-6-8-18(25)27-19(14)17/h1,3-8,11,26H,2,9-10,12H2,(H2,25,27)
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n/an/a 5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152500
PNG
(8-[1-(1-Phenyl-propyl)-pyrrolidin-3-yloxy]-quinoli...)
Show SMILES CCC(N1CCC(C1)Oc1cccc2ccc(N)nc12)c1ccccc1
Show InChI InChI=1S/C22H25N3O/c1-2-19(16-7-4-3-5-8-16)25-14-13-18(15-25)26-20-10-6-9-17-11-12-21(23)24-22(17)20/h3-12,18-19H,2,13-15H2,1H3,(H2,23,24)
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n/an/a 20.5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152499
PNG
(CHEMBL364983 | {8-[1-(2,3-Dihydro-benzo[1,4]dioxin...)
Show SMILES CNc1ccc2cccc(OC3CCN(C3)c3ccc4OCCOc4c3)c2n1
Show InChI InChI=1S/C22H23N3O3/c1-23-21-8-5-15-3-2-4-19(22(15)24-21)28-17-9-10-25(14-17)16-6-7-18-20(13-16)27-12-11-26-18/h2-8,13,17H,9-12,14H2,1H3,(H,23,24)
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n/an/a 25.6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152498
PNG
(8-[(R)-1-(2,2-Difluoro-benzo[1,3]dioxol-5-yl)-pyrr...)
Show SMILES Nc1ccc2cccc(O[C@@H]3CCN(C3)c3ccc4OC(F)(F)Oc4c3)c2n1
Show InChI InChI=1S/C20H17F2N3O3/c21-20(22)27-15-6-5-13(10-17(15)28-20)25-9-8-14(11-25)26-16-3-1-2-12-4-7-18(23)24-19(12)16/h1-7,10,14H,8-9,11H2,(H2,23,24)/t14-/m1/s1
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n/an/a 38.6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152504
PNG
(CHEMBL185266 | {8-[1-(4-Isobutyl-phenyl)-pyrrolidi...)
Show SMILES CC(C)Cc1ccc(cc1)N1CCC(C1)Oc1cccc2ccc(NCc3ccc(o3)-c3cccc(c3)C(F)(F)F)nc12
Show InChI InChI=1S/C35H34F3N3O2/c1-23(2)19-24-9-12-28(13-10-24)41-18-17-30(22-41)43-32-8-4-5-25-11-16-33(40-34(25)32)39-21-29-14-15-31(42-29)26-6-3-7-27(20-26)35(36,37)38/h3-16,20,23,30H,17-19,21-22H2,1-2H3,(H,39,40)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152505
PNG
(8-((S)-1-Benzo[1,3]dioxol-5-ylmethyl-pyrrolidin-3-...)
Show SMILES Nc1ccc2cccc(O[C@H]3CCN(Cc4ccc5OCOc5c4)C3)c2n1
Show InChI InChI=1S/C21H21N3O3/c22-20-7-5-15-2-1-3-18(21(15)23-20)27-16-8-9-24(12-16)11-14-4-6-17-19(10-14)26-13-25-17/h1-7,10,16H,8-9,11-13H2,(H2,22,23)/t16-/m0/s1
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n/an/a 70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152489
PNG
(8-((R)-1-Benzo[1,3]dioxol-5-ylmethyl-pyrrolidin-3-...)
Show SMILES Nc1ccc2cccc(O[C@@H]3CCN(Cc4ccc5OCOc5c4)C3)c2n1
Show InChI InChI=1S/C21H21N3O3/c22-20-7-5-15-2-1-3-18(21(15)23-20)27-16-8-9-24(12-16)11-14-4-6-17-19(10-14)26-13-25-17/h1-7,10,16H,8-9,11-13H2,(H2,22,23)/t16-/m1/s1
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n/an/a 70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152491
PNG
(CHEMBL183468 | N-{4-[(S)-3-(2-Amino-quinolin-8-ylo...)
Show SMILES CC(=O)Nc1ccc(CN2CC[C@@H](C2)Oc2cccc3ccc(N)nc23)cc1
Show InChI InChI=1S/C22H24N4O2/c1-15(27)24-18-8-5-16(6-9-18)13-26-12-11-19(14-26)28-20-4-2-3-17-7-10-21(23)25-22(17)20/h2-10,19H,11-14H2,1H3,(H2,23,25)(H,24,27)/t19-/m0/s1
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n/an/a 90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152424
PNG
(8-Cyclohexylmethoxy-quinolin-2-ylamine | A-224940 ...)
Show SMILES Nc1ccc2cccc(OCC3CCCCC3)c2n1
Show InChI InChI=1S/C16H20N2O/c17-15-10-9-13-7-4-8-14(16(13)18-15)19-11-12-5-2-1-3-6-12/h4,7-10,12H,1-3,5-6,11H2,(H2,17,18)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152503
PNG
(8-((S)-1-Benzyl-pyrrolidin-3-yloxy)-quinolin-2-yla...)
Show SMILES Nc1ccc2cccc(O[C@H]3CCN(Cc4ccccc4)C3)c2n1
Show InChI InChI=1S/C20H21N3O/c21-19-10-9-16-7-4-8-18(20(16)22-19)24-17-11-12-23(14-17)13-15-5-2-1-3-6-15/h1-10,17H,11-14H2,(H2,21,22)/t17-/m0/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152493
PNG
(CHEMBL184277 | Cyclopropylmethyl-{8-[1-(4-isobutyl...)
Show SMILES CC(C)Cc1ccc(cc1)N1CCC(C1)Oc1cccc2ccc(NCC3CC3)nc12
Show InChI InChI=1S/C27H33N3O/c1-19(2)16-20-8-11-23(12-9-20)30-15-14-24(18-30)31-25-5-3-4-22-10-13-26(29-27(22)25)28-17-21-6-7-21/h3-5,8-13,19,21,24H,6-7,14-18H2,1-2H3,(H,28,29)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152490
PNG
(8-[(S)-1-(4-tert-Butyl-benzenesulfonyl)-pyrrolidin...)
Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)N1CC[C@@H](C1)Oc1cccc2ccc(N)nc12
Show InChI InChI=1S/C23H27N3O3S/c1-23(2,3)17-8-10-19(11-9-17)30(27,28)26-14-13-18(15-26)29-20-6-4-5-16-7-12-21(24)25-22(16)20/h4-12,18H,13-15H2,1-3H3,(H2,24,25)/t18-/m0/s1
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152492
PNG
(8-((R)-1-Benzyl-pyrrolidin-3-yloxy)-quinolin-2-yla...)
Show SMILES Nc1ccc2cccc(O[C@@H]3CCN(Cc4ccccc4)C3)c2n1
Show InChI InChI=1S/C20H21N3O/c21-19-10-9-16-7-4-8-18(20(16)22-19)24-17-11-12-23(14-17)13-15-5-2-1-3-6-15/h1-10,17H,11-14H2,(H2,21,22)/t17-/m1/s1
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n/an/a 580n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152501
PNG
(CHEMBL184437 | [(S)-3-(2-Amino-quinolin-8-yloxy)-p...)
Show SMILES Nc1ccc2cccc(O[C@H]3CCN(C3)C(=O)c3ccc4OCOc4c3)c2n1
Show InChI InChI=1S/C21H19N3O4/c22-19-7-5-13-2-1-3-17(20(13)23-19)28-15-8-9-24(11-15)21(25)14-4-6-16-18(10-14)27-12-26-16/h1-7,10,15H,8-9,11-12H2,(H2,22,23)/t15-/m0/s1
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n/an/a 730n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50152496
PNG
(CHEMBL184692 | [8-(1-Benzo[1,3]dioxol-5-yl-pyrroli...)
Show SMILES CN(C)c1ccc2cccc(OC3CCN(C3)c3ccc4OCOc4c3)c2n1
Show InChI InChI=1S/C22H23N3O3/c1-24(2)21-9-6-15-4-3-5-19(22(15)23-21)28-17-10-11-25(13-17)16-7-8-18-20(12-16)27-14-26-18/h3-9,12,17H,10-11,13-14H2,1-2H3
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n/an/a>2.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Concentration required to inhibit binding of [125I]-MCH radioligand to human Melanin-concentrating hormone receptor 1 in IMR-32 I3.4.2 cell membranes

Bioorg Med Chem Lett 14: 4883-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.035
BindingDB Entry DOI: 10.7270/Q2GB23H4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%