BDBM50034692 3-{[(S)-1-((S)-6-Amino-2-tert-butoxycarbonylamino-hexanoyl)-piperidine-3-carbonyl]-amino}-propionic acid::CHEMBL37509

SMILES: CC(C)(C)OC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@@H](C1)C(=O)NCCC(O)=O

InChI Key: InChIKey=RMPDPJUTEPDOAS-GJZGRUSLSA-N

Data: 1 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 1 hit for monomerid = 50034692   

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
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50034692 (3-{[(S)-1-((S)-6-Amino-2-tert-butoxycarbonylamino-...) Show SMILES CC(C)(C)OC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@@H](C1)C(=O)NCCC(O)=O Show InChI InChI=1S/C20H36N4O6/c1-20(2,3)30-19(29)23-15(8-4-5-10-21)18(28)24-12-6-7-14(13-24)17(27)22-11-9-16(25)26/h14-15H,4-13,21H2,1-3H3,(H,22,27)(H,23,29)(H,25,26)/t14-,15-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of biotinylated fibrinogen binding to isolated alpha IIb beta3 integrin				J Med Chem 38: 1582-92 (1995) BindingDB Entry DOI: 10.7270/Q2GB233R
					More data for this Ligand-Target Pair