BDBM50115378 2-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionylamino]-2-phenyl-acetylamino}-5-guanidino-pentanoic acid [1-carbamoyl-2-(1H-indol-3-yl)-ethyl]-amide::CHEMBL318119

SMILES: CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)c1ccccc1

InChI Key: InChIKey=YXCLDFLLWJXJPD-LAJGZZDBSA-N

Data: 3 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50115378   

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 3 (Mus musculus)	BDBM50115378 (2-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionyl...) Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)c1ccccc1 Show InChI InChI=1S/C33H41N11O5/c1-19(45)41-27(15-22-17-37-18-40-22)31(48)44-28(20-8-3-2-4-9-20)32(49)42-25(12-7-13-38-33(35)36)30(47)43-26(29(34)46)14-21-16-39-24-11-6-5-10-23(21)24/h2-6,8-11,16-18,25-28,39H,7,12-15H2,1H3,(H2,34,46)(H,37,40)(H,41,45)(H,42,49)(H,43,47)(H,44,48)(H4,35,36,38)/t25-,26-,27-,28+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Agonist activity to the mouse Melanocortin-3 receptor (mMC3R)				J Med Chem 45: 3073-81 (2002) BindingDB Entry DOI: 10.7270/Q2KK9CHF
					More data for this Ligand-Target Pair
Melanocortin receptor 1 (Mus musculus)	BDBM50115378 (2-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionyl...) Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)c1ccccc1 Show InChI InChI=1S/C33H41N11O5/c1-19(45)41-27(15-22-17-37-18-40-22)31(48)44-28(20-8-3-2-4-9-20)32(49)42-25(12-7-13-38-33(35)36)30(47)43-26(29(34)46)14-21-16-39-24-11-6-5-10-23(21)24/h2-6,8-11,16-18,25-28,39H,7,12-15H2,1H3,(H2,34,46)(H,37,40)(H,41,45)(H,42,49)(H,43,47)(H,44,48)(H4,35,36,38)/t25-,26-,27-,28+/m0/s1	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.69E+4	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Agonist activity to the mouse Melanocortin-1 receptor (mMC1R)				J Med Chem 45: 3073-81 (2002) BindingDB Entry DOI: 10.7270/Q2KK9CHF
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Mus musculus)	BDBM50115378 (2-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionyl...) Show SMILES CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O)c1ccccc1 Show InChI InChI=1S/C33H41N11O5/c1-19(45)41-27(15-22-17-37-18-40-22)31(48)44-28(20-8-3-2-4-9-20)32(49)42-25(12-7-13-38-33(35)36)30(47)43-26(29(34)46)14-21-16-39-24-11-6-5-10-23(21)24/h2-6,8-11,16-18,25-28,39H,7,12-15H2,1H3,(H2,34,46)(H,37,40)(H,41,45)(H,42,49)(H,43,47)(H,44,48)(H4,35,36,38)/t25-,26-,27-,28+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Agonist activity to the mouse Melanocortin-4 receptor (mMC4R)				J Med Chem 45: 3073-81 (2002) BindingDB Entry DOI: 10.7270/Q2KK9CHF
					More data for this Ligand-Target Pair