BDBM50050936 (S)-2-{(S)-2-[(S)-2-(3-tert-Butyl-ureido)-4-methylsulfanyl-butyrylamino]-4-methyl-pentanoylamino}-3-phenyl-propionic acid::CHEMBL415299

SMILES: CSCC[C@H](NC(=O)NC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O

InChI Key: InChIKey=VTPZZLXHIZSCRN-UFYCRDLUSA-N

Data: 2 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 2 hits for monomerid = 50050936   

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
fMet-Leu-Phe receptor (Homo sapiens (Human))	BDBM50050936 ((S)-2-{(S)-2-[(S)-2-(3-tert-Butyl-ureido)-4-methyl...) Show SMILES CSCC[C@H](NC(=O)NC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C25H40N4O5S/c1-16(2)14-19(22(31)27-20(23(32)33)15-17-10-8-7-9-11-17)26-21(30)18(12-13-35-6)28-24(34)29-25(3,4)5/h7-11,16,18-20H,12-15H2,1-6H3,(H,26,30)(H,27,31)(H,32,33)(H2,28,29,34)/t18-,19-,20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson Matthey Biomedical Research Curated by ChEMBL					Assay Description Binding affinity towards fMLF receptor using human neutrophils				J Med Chem 39: 1013-5 (1996) Article DOI: 10.1021/jm950908d BindingDB Entry DOI: 10.7270/Q2TD9WF6
					More data for this Ligand-Target Pair
fMet-Leu-Phe receptor (Homo sapiens (Human))	BDBM50050936 ((S)-2-{(S)-2-[(S)-2-(3-tert-Butyl-ureido)-4-methyl...) Show SMILES CSCC[C@H](NC(=O)NC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C25H40N4O5S/c1-16(2)14-19(22(31)27-20(23(32)33)15-17-10-8-7-9-11-17)26-21(30)18(12-13-35-6)28-24(34)29-25(3,4)5/h7-11,16,18-20H,12-15H2,1-6H3,(H,26,30)(H,27,31)(H,32,33)(H2,28,29,34)/t18-,19-,20-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson Matthey Biomedical Research Curated by ChEMBL					Assay Description Antagonistic activity was determined by measuring the ability to inhibit superoxide production(stimulated by fMLF) using human neutrophils				J Med Chem 39: 1013-5 (1996) Article DOI: 10.1021/jm950908d BindingDB Entry DOI: 10.7270/Q2TD9WF6
					More data for this Ligand-Target Pair