Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 870.7 BDBM50266697

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

Found 3 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
Melanocortin receptor 4 (Mus musculus)	BDBM50266697 (CHEMBL4100584) Show SMILES CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C42H47IN8O5/c1-26(52)51-25-32-11-6-5-10-31(32)24-37(51)41(56)48-34(12-7-21-47-42(45)46)39(54)50-36(23-28-15-19-33(43)20-16-28)40(55)49-35(38(44)53)22-27-13-17-30(18-14-27)29-8-3-2-4-9-29/h2-6,8-11,13-20,34-37H,7,12,21-25H2,1H3,(H2,44,53)(H,48,56)(H,49,55)(H,50,54)(H4,45,46,47)/t34-,35-,36+,37-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Agonist activity at mouse MC4R expressed in HEK293 cells assessed as induction of cAMP accumulation after 2 hrs by alpha screen assay				J Med Chem 60: 4342-4357 (2017) Article DOI: 10.1021/acs.jmedchem.7b00301 BindingDB Entry DOI: 10.7270/Q24170J1
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (Mus musculus (Mouse))	BDBM50266697 (CHEMBL4100584) Show SMILES CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C42H47IN8O5/c1-26(52)51-25-32-11-6-5-10-31(32)24-37(51)41(56)48-34(12-7-21-47-42(45)46)39(54)50-36(23-28-15-19-33(43)20-16-28)40(55)49-35(38(44)53)22-27-13-17-30(18-14-27)29-8-3-2-4-9-29/h2-6,8-11,13-20,34-37H,7,12,21-25H2,1H3,(H2,44,53)(H,48,56)(H,49,55)(H,50,54)(H4,45,46,47)/t34-,35-,36+,37-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.10E+4	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Agonist activity at mouse MC5R expressed in HEK293 cells assessed as induction of cAMP accumulation after 2 hrs by alpha screen assay				J Med Chem 60: 4342-4357 (2017) Article DOI: 10.1021/acs.jmedchem.7b00301 BindingDB Entry DOI: 10.7270/Q24170J1
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Mus musculus)	BDBM50266697 (CHEMBL4100584) Show SMILES CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(N)=O |r| Show InChI InChI=1S/C42H47IN8O5/c1-26(52)51-25-32-11-6-5-10-31(32)24-37(51)41(56)48-34(12-7-21-47-42(45)46)39(54)50-36(23-28-15-19-33(43)20-16-28)40(55)49-35(38(44)53)22-27-13-17-30(18-14-27)29-8-3-2-4-9-29/h2-6,8-11,13-20,34-37H,7,12,21-25H2,1H3,(H2,44,53)(H,48,56)(H,49,55)(H,50,54)(H4,45,46,47)/t34-,35-,36+,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Agonist activity at mouse MC3R expressed in HEK293 cells assessed as induction of cAMP accumulation after 2 hrs by alpha screen assay				J Med Chem 60: 4342-4357 (2017) Article DOI: 10.1021/acs.jmedchem.7b00301 BindingDB Entry DOI: 10.7270/Q24170J1
					More data for this Ligand-Target Pair