BDBM50421471 CHEMBL443527

SMILES: CC(C)[C@@H](CC(=O)N1CCC(CC(O)=O)CC1)NC(=O)c1ccc(cc1)C(N)=N

InChI Key: InChIKey=MMJDSYMWFNEGIL-QGZVFWFLSA-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 = 50421471   

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))	BDBM50421471 (CHEMBL443527) Show SMILES CC(C)[C@@H](CC(=O)N1CCC(CC(O)=O)CC1)NC(=O)c1ccc(cc1)C(N)=N Show InChI InChI=1S/C21H30N4O4/c1-13(2)17(24-21(29)16-5-3-15(4-6-16)20(22)23)12-18(26)25-9-7-14(8-10-25)11-19(27)28/h3-6,13-14,17H,7-12H2,1-2H3,(H3,22,23)(H,24,29)(H,27,28)/t17-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description The compound was tested for its inhibitory activity against platelet aggregation				Bioorg Med Chem Lett 10: 859-63 (2000) BindingDB Entry DOI: 10.7270/Q2W95BFN
					More data for this Ligand-Target Pair