BDBM50034691 3-{[1-(6-Amino-hexanoyl)-piperidin-3-ylmethyl]-amino}-propionic acid::CHEMBL40630

SMILES: NCCCCCC(=O)N1CCCC(CNCCC(O)=O)C1

InChI Key: InChIKey=ULDTXZLEUOWNNY-UHFFFAOYSA-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 = 50034691   

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))	BDBM50034691 (3-{[1-(6-Amino-hexanoyl)-piperidin-3-ylmethyl]-ami...) Show SMILES NCCCCCC(=O)N1CCCC(CNCCC(O)=O)C1 Show InChI InChI=1S/C15H29N3O3/c16-8-3-1-2-6-14(19)18-10-4-5-13(12-18)11-17-9-7-15(20)21/h13,17H,1-12,16H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.80E+3	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