Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 613.7 BDBM50191566

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 6 hits in this display   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50191566 (CHEMBL377778 | N-((R)-1-((2R,4R)-2-(2-guanidinoeth...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#6]-[#6@H](-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-[#8]-[#6]-c1ccc2ccccc2c1 Show InChI InChI=1S/C34H43N7O4/c35-34(36)39-17-16-38-32(43)30-20-28(45-22-24-10-11-25-8-4-5-9-27(25)18-24)21-41(30)33(44)29(19-23-6-2-1-3-7-23)40-31(42)26-12-14-37-15-13-26/h1-11,18,26,28-30,37H,12-17,19-22H2,(H,38,43)(H,40,42)(H4,35,36,39)/t28-,29-,30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	121	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of europium labeled NDP-alpha-MSH from human MC1R expressed in HEK293 cells				J Med Chem 49: 4745-61 (2006) Article DOI: 10.1021/jm060384p BindingDB Entry DOI: 10.7270/Q29W0F4J
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50191566 (CHEMBL377778 | N-((R)-1-((2R,4R)-2-(2-guanidinoeth...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#6]-[#6@H](-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-[#8]-[#6]-c1ccc2ccccc2c1 Show InChI InChI=1S/C34H43N7O4/c35-34(36)39-17-16-38-32(43)30-20-28(45-22-24-10-11-25-8-4-5-9-27(25)18-24)21-41(30)33(44)29(19-23-6-2-1-3-7-23)40-31(42)26-12-14-37-15-13-26/h1-11,18,26,28-30,37H,12-17,19-22H2,(H,38,43)(H,40,42)(H4,35,36,39)/t28-,29-,30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of europium labeled NDP-alpha-MSH from human MC4R expressed in HEK293 cells				J Med Chem 49: 4745-61 (2006) Article DOI: 10.1021/jm060384p BindingDB Entry DOI: 10.7270/Q29W0F4J
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50191566 (CHEMBL377778 | N-((R)-1-((2R,4R)-2-(2-guanidinoeth...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#6]-[#6@H](-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-[#8]-[#6]-c1ccc2ccccc2c1 Show InChI InChI=1S/C34H43N7O4/c35-34(36)39-17-16-38-32(43)30-20-28(45-22-24-10-11-25-8-4-5-9-27(25)18-24)21-41(30)33(44)29(19-23-6-2-1-3-7-23)40-31(42)26-12-14-37-15-13-26/h1-11,18,26,28-30,37H,12-17,19-22H2,(H,38,43)(H,40,42)(H4,35,36,39)/t28-,29-,30-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of europium labeled NDP-alpha-MSH from human MC3R expressed in HEK293 cells				J Med Chem 49: 4745-61 (2006) Article DOI: 10.1021/jm060384p BindingDB Entry DOI: 10.7270/Q29W0F4J
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50191566 (CHEMBL377778 | N-((R)-1-((2R,4R)-2-(2-guanidinoeth...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#6]-[#6@H](-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-[#8]-[#6]-c1ccc2ccccc2c1 Show InChI InChI=1S/C34H43N7O4/c35-34(36)39-17-16-38-32(43)30-20-28(45-22-24-10-11-25-8-4-5-9-27(25)18-24)21-41(30)33(44)29(19-23-6-2-1-3-7-23)40-31(42)26-12-14-37-15-13-26/h1-11,18,26,28-30,37H,12-17,19-22H2,(H,38,43)(H,40,42)(H4,35,36,39)/t28-,29-,30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	501	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC4R transfected in HEK293 cells				J Med Chem 49: 4745-61 (2006) Article DOI: 10.1021/jm060384p BindingDB Entry DOI: 10.7270/Q29W0F4J
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50191566 (CHEMBL377778 | N-((R)-1-((2R,4R)-2-(2-guanidinoeth...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#6]-[#6@H](-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-[#8]-[#6]-c1ccc2ccccc2c1 Show InChI InChI=1S/C34H43N7O4/c35-34(36)39-17-16-38-32(43)30-20-28(45-22-24-10-11-25-8-4-5-9-27(25)18-24)21-41(30)33(44)29(19-23-6-2-1-3-7-23)40-31(42)26-12-14-37-15-13-26/h1-11,18,26,28-30,37H,12-17,19-22H2,(H,38,43)(H,40,42)(H4,35,36,39)/t28-,29-,30-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.47E+3	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC3R transfected in HEK293 cells				J Med Chem 49: 4745-61 (2006) Article DOI: 10.1021/jm060384p BindingDB Entry DOI: 10.7270/Q29W0F4J
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50191566 (CHEMBL377778 | N-((R)-1-((2R,4R)-2-(2-guanidinoeth...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-[#6](=O)-[#6@H]-1-[#6]-[#6@H](-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-1-[#6]-[#6]-[#7]-[#6]-[#6]-1)-[#8]-[#6]-c1ccc2ccccc2c1 Show InChI InChI=1S/C34H43N7O4/c35-34(36)39-17-16-38-32(43)30-20-28(45-22-24-10-11-25-8-4-5-9-27(25)18-24)21-41(30)33(44)29(19-23-6-2-1-3-7-23)40-31(42)26-12-14-37-15-13-26/h1-11,18,26,28-30,37H,12-17,19-22H2,(H,38,43)(H,40,42)(H4,35,36,39)/t28-,29-,30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	104	n/a	n/a	n/a	n/a
Procter & Gamble Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human MC1R transfected in HEK293 cells				J Med Chem 49: 4745-61 (2006) Article DOI: 10.1021/jm060384p BindingDB Entry DOI: 10.7270/Q29W0F4J
					More data for this Ligand-Target Pair