BDBM50250589 CHEMBL4060000

SMILES: CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O

InChI Key: InChIKey=SPJYDEIJYHHMBB-JDFSLKTNSA-N

Data: 3 IC50

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 = 50250589   

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 (Homo sapiens (Human))	BDBM50250589 (CHEMBL4060000) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C74H101N17O15/c1-41(2)31-53(89-73(106)63(43(5)6)90-64(97)50(75)33-46-25-27-48(92)28-26-46)65(98)82-40-61(94)91-30-16-24-59(91)72(105)88-56(35-45-19-11-8-12-20-45)69(102)84-54(32-42(3)4)68(101)86-57(36-47-38-80-51-22-14-13-21-49(47)51)70(103)87-58(37-62(95)96)71(104)83-52(23-15-29-79-74(77)78)67(100)85-55(66(99)81-39-60(76)93)34-44-17-9-7-10-18-44/h7-14,17-22,25-28,38,41-43,50,52-59,63,80,92H,15-16,23-24,29-37,39-40,75H2,1-6H3,(H2,76,93)(H,81,99)(H,82,98)(H,83,104)(H,84,102)(H,85,100)(H,86,101)(H,87,103)(H,88,105)(H,89,106)(H,90,97)(H,95,96)(H4,77,78,79)/t50-,52-,53-,54-,55-,56-,57-,58-,59-,63-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	117	n/a	n/a	n/a	n/a	n/a	n/a
The University of Arizona Curated by ChEMBL					Assay Description Displacement of [125I]-NDP-alpha-MSH from human MC3R expressed in HEK293 cells after 40 mins by gamma counting method				J Med Chem 60: 9320-9329 (2017) Article DOI: 10.1021/acs.jmedchem.7b01295 BindingDB Entry DOI: 10.7270/Q2XG9TJB
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (Homo sapiens (Human))	BDBM50250589 (CHEMBL4060000) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C74H101N17O15/c1-41(2)31-53(89-73(106)63(43(5)6)90-64(97)50(75)33-46-25-27-48(92)28-26-46)65(98)82-40-61(94)91-30-16-24-59(91)72(105)88-56(35-45-19-11-8-12-20-45)69(102)84-54(32-42(3)4)68(101)86-57(36-47-38-80-51-22-14-13-21-49(47)51)70(103)87-58(37-62(95)96)71(104)83-52(23-15-29-79-74(77)78)67(100)85-55(66(99)81-39-60(76)93)34-44-17-9-7-10-18-44/h7-14,17-22,25-28,38,41-43,50,52-59,63,80,92H,15-16,23-24,29-37,39-40,75H2,1-6H3,(H2,76,93)(H,81,99)(H,82,98)(H,83,104)(H,84,102)(H,85,100)(H,86,101)(H,87,103)(H,88,105)(H,89,106)(H,90,97)(H,95,96)(H4,77,78,79)/t50-,52-,53-,54-,55-,56-,57-,58-,59-,63-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.420	n/a	n/a	n/a	n/a	n/a	n/a
The University of Arizona Curated by ChEMBL					Assay Description Agonist activity at human MC5R expressed in HEK293 cells assessed as induction of intracellular cAMP accumulation after 3 mins				J Med Chem 60: 9320-9329 (2017) Article DOI: 10.1021/acs.jmedchem.7b01295 BindingDB Entry DOI: 10.7270/Q2XG9TJB
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50250589 (CHEMBL4060000) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C74H101N17O15/c1-41(2)31-53(89-73(106)63(43(5)6)90-64(97)50(75)33-46-25-27-48(92)28-26-46)65(98)82-40-61(94)91-30-16-24-59(91)72(105)88-56(35-45-19-11-8-12-20-45)69(102)84-54(32-42(3)4)68(101)86-57(36-47-38-80-51-22-14-13-21-49(47)51)70(103)87-58(37-62(95)96)71(104)83-52(23-15-29-79-74(77)78)67(100)85-55(66(99)81-39-60(76)93)34-44-17-9-7-10-18-44/h7-14,17-22,25-28,38,41-43,50,52-59,63,80,92H,15-16,23-24,29-37,39-40,75H2,1-6H3,(H2,76,93)(H,81,99)(H,82,98)(H,83,104)(H,84,102)(H,85,100)(H,86,101)(H,87,103)(H,88,105)(H,89,106)(H,90,97)(H,95,96)(H4,77,78,79)/t50-,52-,53-,54-,55-,56-,57-,58-,59-,63-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
The University of Arizona Curated by ChEMBL					Assay Description Displacement of [125I]-NDP-alpha-MSH from human MC1R expressed in HEK293 cells after 40 mins by gamma counting method				J Med Chem 60: 9320-9329 (2017) Article DOI: 10.1021/acs.jmedchem.7b01295 BindingDB Entry DOI: 10.7270/Q2XG9TJB
					More data for this Ligand-Target Pair