BDBM50410241 CHEMBL188459

SMILES: CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O

InChI Key: InChIKey=LHQTXYAFAPISTL-PDHQKIGBSA-N

Data: 3 IC50  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 6 hits for monomerid = 50410241   

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))	BDBM50410241 (CHEMBL188459) Show SMILES CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O Show InChI InChI=1S/C44H65N13O8/c1-3-4-20-56(29(2)58)27-38(60)51-26-40(62)57(21-11-10-18-45)28-39(61)53-35(22-30-13-6-5-7-14-30)43(65)54-34(17-12-19-49-44(47)48)42(64)55-36(41(63)52-25-37(46)59)23-31-24-50-33-16-9-8-15-32(31)33/h5-9,13-16,24,34-36,50H,3-4,10-12,17-23,25-28,45H2,1-2H3,(H2,46,59)(H,51,60)(H,52,63)(H,53,61)(H,54,65)(H,55,64)(H4,47,48,49)/t34-,35+,36-/m0/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	63	n/a	n/a	n/a	n/a
Utrecht University Curated by ChEMBL					Assay Description Effective concentration against human melanocortin receptor-4 expressed in 293 HEK cells				J Med Chem 48: 4224-30 (2005) Article DOI: 10.1021/jm0490033 BindingDB Entry DOI: 10.7270/Q2QV3NQ5
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Mus musculus (Mouse))	BDBM50410241 (CHEMBL188459) Show SMILES CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O Show InChI InChI=1S/C44H65N13O8/c1-3-4-20-56(29(2)58)27-38(60)51-26-40(62)57(21-11-10-18-45)28-39(61)53-35(22-30-13-6-5-7-14-30)43(65)54-34(17-12-19-49-44(47)48)42(64)55-36(41(63)52-25-37(46)59)23-31-24-50-33-16-9-8-15-32(31)33/h5-9,13-16,24,34-36,50H,3-4,10-12,17-23,25-28,45H2,1-2H3,(H2,46,59)(H,51,60)(H,52,63)(H,53,61)(H,54,65)(H,55,64)(H4,47,48,49)/t34-,35+,36-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	794	n/a	n/a	n/a	n/a	n/a	n/a
Utrecht University Curated by ChEMBL					Assay Description Displacement of [125I]NDP-MSH from mouse melanocortin receptor-5 expressed in 293 HEK cells				J Med Chem 48: 4224-30 (2005) Article DOI: 10.1021/jm0490033 BindingDB Entry DOI: 10.7270/Q2QV3NQ5
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50410241 (CHEMBL188459) Show SMILES CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O Show InChI InChI=1S/C44H65N13O8/c1-3-4-20-56(29(2)58)27-38(60)51-26-40(62)57(21-11-10-18-45)28-39(61)53-35(22-30-13-6-5-7-14-30)43(65)54-34(17-12-19-49-44(47)48)42(64)55-36(41(63)52-25-37(46)59)23-31-24-50-33-16-9-8-15-32(31)33/h5-9,13-16,24,34-36,50H,3-4,10-12,17-23,25-28,45H2,1-2H3,(H2,46,59)(H,51,60)(H,52,63)(H,53,61)(H,54,65)(H,55,64)(H4,47,48,49)/t34-,35+,36-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Utrecht University Curated by ChEMBL					Assay Description Displacement of [125I]NDP-MSH from human melanocortin receptor-4 expressed in 293 HEK cells				J Med Chem 48: 4224-30 (2005) Article DOI: 10.1021/jm0490033 BindingDB Entry DOI: 10.7270/Q2QV3NQ5
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50410241 (CHEMBL188459) Show SMILES CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O Show InChI InChI=1S/C44H65N13O8/c1-3-4-20-56(29(2)58)27-38(60)51-26-40(62)57(21-11-10-18-45)28-39(61)53-35(22-30-13-6-5-7-14-30)43(65)54-34(17-12-19-49-44(47)48)42(64)55-36(41(63)52-25-37(46)59)23-31-24-50-33-16-9-8-15-32(31)33/h5-9,13-16,24,34-36,50H,3-4,10-12,17-23,25-28,45H2,1-2H3,(H2,46,59)(H,51,60)(H,52,63)(H,53,61)(H,54,65)(H,55,64)(H4,47,48,49)/t34-,35+,36-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Utrecht University Curated by ChEMBL					Assay Description Effective concentration against human melanocortin receptor-3 expressed in 293 HEK cells				J Med Chem 48: 4224-30 (2005) Article DOI: 10.1021/jm0490033 BindingDB Entry DOI: 10.7270/Q2QV3NQ5
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Mus musculus (Mouse))	BDBM50410241 (CHEMBL188459) Show SMILES CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O Show InChI InChI=1S/C44H65N13O8/c1-3-4-20-56(29(2)58)27-38(60)51-26-40(62)57(21-11-10-18-45)28-39(61)53-35(22-30-13-6-5-7-14-30)43(65)54-34(17-12-19-49-44(47)48)42(64)55-36(41(63)52-25-37(46)59)23-31-24-50-33-16-9-8-15-32(31)33/h5-9,13-16,24,34-36,50H,3-4,10-12,17-23,25-28,45H2,1-2H3,(H2,46,59)(H,51,60)(H,52,63)(H,53,61)(H,54,65)(H,55,64)(H4,47,48,49)/t34-,35+,36-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.94E+3	n/a	n/a	n/a	n/a
Utrecht University Curated by ChEMBL					Assay Description Effective concentration against mouse melanocortin receptor-5 expressed in 293 HEK cells				J Med Chem 48: 4224-30 (2005) Article DOI: 10.1021/jm0490033 BindingDB Entry DOI: 10.7270/Q2QV3NQ5
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50410241 (CHEMBL188459) Show SMILES CCCCN(CC(=O)NCC(=O)N(CCCCN)CC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O)C(C)=O Show InChI InChI=1S/C44H65N13O8/c1-3-4-20-56(29(2)58)27-38(60)51-26-40(62)57(21-11-10-18-45)28-39(61)53-35(22-30-13-6-5-7-14-30)43(65)54-34(17-12-19-49-44(47)48)42(64)55-36(41(63)52-25-37(46)59)23-31-24-50-33-16-9-8-15-32(31)33/h5-9,13-16,24,34-36,50H,3-4,10-12,17-23,25-28,45H2,1-2H3,(H2,46,59)(H,51,60)(H,52,63)(H,53,61)(H,54,65)(H,55,64)(H4,47,48,49)/t34-,35+,36-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
Utrecht University Curated by ChEMBL					Assay Description Effective concentration against human melanocortin receptor-3 expressed in 293 HEK cells				J Med Chem 48: 4224-30 (2005) Article DOI: 10.1021/jm0490033 BindingDB Entry DOI: 10.7270/Q2QV3NQ5
					More data for this Ligand-Target Pair