Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 440.5 BDBM50111183

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

Found 4 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))	BDBM50111183 ((2S)-5-[(E)-[amino(azaniumyl)methylidene]amino]-N-...) Show SMILES [NH3+]C(=N)NCCC[C@H](NCc1ccc2ccccc2c1)C(=O)Nc1cccc2ccccc12 Show InChI InChI=1S/C27H29N5O/c28-27(29)30-16-6-13-25(31-18-19-14-15-20-7-1-2-9-22(20)17-19)26(33)32-24-12-5-10-21-8-3-4-11-23(21)24/h1-5,7-12,14-15,17,25,31H,6,13,16,18H2,(H,32,33)(H4,28,29,30)/p+1/t25-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity in competition with [125I]NDP-MSH on recombinant melanocortin 1 receptor				Bioorg Med Chem Lett 12: 1039-42 (2002) BindingDB Entry DOI: 10.7270/Q2833SKD
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50111183 ((2S)-5-[(E)-[amino(azaniumyl)methylidene]amino]-N-...) Show SMILES [NH3+]C(=N)NCCC[C@H](NCc1ccc2ccccc2c1)C(=O)Nc1cccc2ccccc12 Show InChI InChI=1S/C27H29N5O/c28-27(29)30-16-6-13-25(31-18-19-14-15-20-7-1-2-9-22(20)17-19)26(33)32-24-12-5-10-21-8-3-4-11-23(21)24/h1-5,7-12,14-15,17,25,31H,6,13,16,18H2,(H,32,33)(H4,28,29,30)/p+1/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity in competition with [125I]NDP-MSH on recombinant melanocortin 3 receptor				Bioorg Med Chem Lett 12: 1039-42 (2002) BindingDB Entry DOI: 10.7270/Q2833SKD
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50111183 ((2S)-5-[(E)-[amino(azaniumyl)methylidene]amino]-N-...) Show SMILES [NH3+]C(=N)NCCC[C@H](NCc1ccc2ccccc2c1)C(=O)Nc1cccc2ccccc12 Show InChI InChI=1S/C27H29N5O/c28-27(29)30-16-6-13-25(31-18-19-14-15-20-7-1-2-9-22(20)17-19)26(33)32-24-12-5-10-21-8-3-4-11-23(21)24/h1-5,7-12,14-15,17,25,31H,6,13,16,18H2,(H,32,33)(H4,28,29,30)/p+1/t25-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity in competition with [125I]NDP-MSH on recombinant melanocortin 4 receptor				Bioorg Med Chem Lett 12: 1039-42 (2002) BindingDB Entry DOI: 10.7270/Q2833SKD
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (Homo sapiens (Human))	BDBM50111183 ((2S)-5-[(E)-[amino(azaniumyl)methylidene]amino]-N-...) Show SMILES [NH3+]C(=N)NCCC[C@H](NCc1ccc2ccccc2c1)C(=O)Nc1cccc2ccccc12 Show InChI InChI=1S/C27H29N5O/c28-27(29)30-16-6-13-25(31-18-19-14-15-20-7-1-2-9-22(20)17-19)26(33)32-24-12-5-10-21-8-3-4-11-23(21)24/h1-5,7-12,14-15,17,25,31H,6,13,16,18H2,(H,32,33)(H4,28,29,30)/p+1/t25-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Binding affinity in competition with [125I]NDP-MSH on recombinant melanocortin 5 receptor				Bioorg Med Chem Lett 12: 1039-42 (2002) BindingDB Entry DOI: 10.7270/Q2833SKD
					More data for this Ligand-Target Pair