BDBM50336911 (S)-2-((S)-2-((S)-5-amino-2-((S)-1-((S)-2-((S)-2-((S)-2-((S)-2-amino-3-hydroxypropanamido)-4-methylpentanamido)propanamido)propanoyl)pyrrolidine-2-carboxamido)-5-oxopentanamido)-5-guanidinopentanamido)-3-phenylpropanoic acid::CHEMBL1672379

SMILES: [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O

InChI Key: InChIKey=NHCZEDDUCRWXKT-CJKZIAQFSA-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 = 50336911   

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
G-protein Coupled Receptor 54 (Homo sapiens (Human))	BDBM50336911 ((S)-2-((S)-2-((S)-5-amino-2-((S)-1-((S)-2-((S)-2-(...) Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O |r| Show InChI InChI=1S/C40H64N12O11/c1-21(2)18-28(50-33(56)25(41)20-53)36(59)46-22(3)32(55)47-23(4)38(61)52-17-9-13-30(52)37(60)49-27(14-15-31(42)54)35(58)48-26(12-8-16-45-40(43)44)34(57)51-29(39(62)63)19-24-10-6-5-7-11-24/h5-7,10-11,21-23,25-30,53H,8-9,12-20,41H2,1-4H3,(H2,42,54)(H,46,59)(H,47,55)(H,48,58)(H,49,60)(H,50,56)(H,51,57)(H,62,63)(H4,43,44,45)/t22-,23-,25-,26-,27-,28-,29-,30-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of [125I]kisspeptin-15 from GPR54				ACS Med Chem Lett 2: 53-57 (2011) Article DOI: 10.1021/ml1002053 BindingDB Entry DOI: 10.7270/Q2K07586
					More data for this Ligand-Target Pair
NPFF2 (Homo sapiens (Human))	BDBM50336911 ((S)-2-((S)-2-((S)-5-amino-2-((S)-1-((S)-2-((S)-2-(...) Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O |r| Show InChI InChI=1S/C40H64N12O11/c1-21(2)18-28(50-33(56)25(41)20-53)36(59)46-22(3)32(55)47-23(4)38(61)52-17-9-13-30(52)37(60)49-27(14-15-31(42)54)35(58)48-26(12-8-16-45-40(43)44)34(57)51-29(39(62)63)19-24-10-6-5-7-11-24/h5-7,10-11,21-23,25-30,53H,8-9,12-20,41H2,1-4H3,(H2,42,54)(H,46,59)(H,47,55)(H,48,58)(H,49,60)(H,50,56)(H,51,57)(H,62,63)(H4,43,44,45)/t22-,23-,25-,26-,27-,28-,29-,30-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of (D-[125I]Tyr1, MePhe3)-NPFF from NPFFR2 after 2 hrs				ACS Med Chem Lett 2: 53-57 (2011) Article DOI: 10.1021/ml1002053 BindingDB Entry DOI: 10.7270/Q2K07586
					More data for this Ligand-Target Pair
Neuropeptide FF receptor 1 (Homo sapiens (Human))	BDBM50336911 ((S)-2-((S)-2-((S)-5-amino-2-((S)-1-((S)-2-((S)-2-(...) Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O |r| Show InChI InChI=1S/C40H64N12O11/c1-21(2)18-28(50-33(56)25(41)20-53)36(59)46-22(3)32(55)47-23(4)38(61)52-17-9-13-30(52)37(60)49-27(14-15-31(42)54)35(58)48-26(12-8-16-45-40(43)44)34(57)51-29(39(62)63)19-24-10-6-5-7-11-24/h5-7,10-11,21-23,25-30,53H,8-9,12-20,41H2,1-4H3,(H2,42,54)(H,46,59)(H,47,55)(H,48,58)(H,49,60)(H,50,56)(H,51,57)(H,62,63)(H4,43,44,45)/t22-,23-,25-,26-,27-,28-,29-,30-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of (D-[125I]Tyr1, MePhe3)-NPFF from NPFFR1 after 2 hrs				ACS Med Chem Lett 2: 53-57 (2011) Article DOI: 10.1021/ml1002053 BindingDB Entry DOI: 10.7270/Q2K07586
					More data for this Ligand-Target Pair