BDBM50142895 2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-4,5-dihydro-1H-imidazole::2-phenylimidazoline::2-{2-[2-(5-Bromo-2-methoxy-phenyl)-ethyl]-3-fluoro-phenyl}-4,5-dihydro-1H-imidazole::CHEMBL40711::ML-253764
SMILES: COc1ccc(Br)cc1CCc1c(F)cccc1C1=NCCN1
InChI Key: InChIKey=WCPPZGPJRHLSKP-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 120 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R I125A expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 151 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R Y268F expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences, Inc. Curated by ChEMBL | Assay Description Binding affinity for melanocortin-4 receptor transfected in HEK 293 cells using [125I]-NDP-MSH as radioligand | Bioorg Med Chem Lett 15: 2541-6 (2005) Article DOI: 10.1016/j.bmcl.2005.03.053 BindingDB Entry DOI: 10.7270/Q22Z1527 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Mus musculus) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Antagonistic activity of the compound was determined against mice melanocortin 4 receptor using [125I]-[NDP]-R-MSH as radioligand in a membranefiltra... | J Med Chem 47: 1602-4 (2004) Article DOI: 10.1021/jm034244g BindingDB Entry DOI: 10.7270/Q2JQ10GG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from human wild type MC4R expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R I291A expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 560 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R Y287F expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 870 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R Y268A expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 890 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R F184A expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 1.82E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R F184L expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R Y287A expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 2.99E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Displacement of [125I]NDP-alpha-MSH from mutant MC4R I129A expressed in HEK293 cells | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R I125A expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R Y268A expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R F184L expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 560 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the human wild type MC4R expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R Y287A expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R Y268F expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 355 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R Y287F expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 6.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R I125L expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 708 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R I291A expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences, Inc. Curated by ChEMBL | Assay Description Antagonist activity at human MC4R expressed in CHO cells assessed as inhibition of alpha-MSH-induced cAMP production by ELISA | Bioorg Med Chem 16: 5606-18 (2008) Article DOI: 10.1016/j.bmc.2008.03.072 BindingDB Entry DOI: 10.7270/Q2TX3F54 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 3.77E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Curated by ChEMBL | Assay Description Antagonist activity at the mutant MC4R F184A expressed in HEK293 cells by cAMP accumulation | J Med Chem 49: 911-22 (2006) Article DOI: 10.1021/jm050780s BindingDB Entry DOI: 10.7270/Q2D21ZCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50142895 (2-(2-(5-bromo-2-methoxyphenethyl)-3-fluorophenyl)-...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 103 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences, Inc. Curated by ChEMBL | Assay Description Antagonist activity at MC4R (unknown origin) | Bioorg Med Chem 16: 5606-18 (2008) Article DOI: 10.1016/j.bmc.2008.03.072 BindingDB Entry DOI: 10.7270/Q2TX3F54 | |||||||||||
More data for this Ligand-Target Pair |