BDBM50215468 CHEMBL36684

SMILES: NC(=N)c1ccc(CN2CCN(CC2)c2ccc(CC(O)=O)cc2)cc1

InChI Key: InChIKey=YYVDLBXODNLPJO-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 = 50215468   

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))	BDBM50215468 (CHEMBL36684) Show SMILES NC(=N)c1ccc(CN2CCN(CC2)c2ccc(CC(O)=O)cc2)cc1 Show InChI InChI=1S/C20H24N4O2/c21-20(22)17-5-1-16(2-6-17)14-23-9-11-24(12-10-23)18-7-3-15(4-8-18)13-19(25)26/h1-8H,9-14H2,(H3,21,22)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description Inhibition of fibrinogen binding to platelet glycoprotein alpha IIb beta-3 integrin in ELISA				Bioorg Med Chem Lett 8: 1531-6 (1998) BindingDB Entry DOI: 10.7270/Q21838P3
					More data for this Ligand-Target Pair