BDBM50250588 CHEMBL4103570

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](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)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=DTSQZRACMCUTMR-OWPINPDTSA-N

Data: 1 IC50  1 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 2 hits for monomerid = 50250588   

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
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50250588 (CHEMBL4103570) 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](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)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/C72H101N19O15/c1-41(2)33-51(89-70(106)60(42(3)4)90-61(97)48(73)34-46-26-28-47(92)29-27-46)62(98)82-40-58(94)91-32-16-25-56(91)69(105)88-54(37-45-21-12-7-13-22-45)66(102)83-50(24-15-31-80-72(77)78)65(101)86-53(36-44-19-10-6-11-20-44)67(103)87-55(38-59(95)96)68(104)84-49(23-14-30-79-71(75)76)64(100)85-52(63(99)81-39-57(74)93)35-43-17-8-5-9-18-43/h5-13,17-22,26-29,41-42,48-56,60,92H,14-16,23-25,30-40,73H2,1-4H3,(H2,74,93)(H,81,99)(H,82,98)(H,83,102)(H,84,104)(H,85,100)(H,86,101)(H,87,103)(H,88,105)(H,89,106)(H,90,97)(H,95,96)(H4,75,76,79)(H4,77,78,80)/t48-,49-,50-,51-,52-,53-,54-,55-,56-,60-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	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
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50250588 (CHEMBL4103570) 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](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)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/C72H101N19O15/c1-41(2)33-51(89-70(106)60(42(3)4)90-61(97)48(73)34-46-26-28-47(92)29-27-46)62(98)82-40-58(94)91-32-16-25-56(91)69(105)88-54(37-45-21-12-7-13-22-45)66(102)83-50(24-15-31-80-72(77)78)65(101)86-53(36-44-19-10-6-11-20-44)67(103)87-55(38-59(95)96)68(104)84-49(23-14-30-79-71(75)76)64(100)85-52(63(99)81-39-57(74)93)35-43-17-8-5-9-18-43/h5-13,17-22,26-29,41-42,48-56,60,92H,14-16,23-25,30-40,73H2,1-4H3,(H2,74,93)(H,81,99)(H,82,98)(H,83,102)(H,84,104)(H,85,100)(H,86,101)(H,87,103)(H,88,105)(H,89,106)(H,90,97)(H,95,96)(H4,75,76,79)(H4,77,78,80)/t48-,49-,50-,51-,52-,53-,54-,55-,56-,60-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	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