BDBM50400042 CHEMBL2177728

SMILES: COc1ccc(Nc2nc(nc3scnc23)N2CCC(C2)C(=O)Nc2ccc(cc2)C(O)=O)cc1OC

InChI Key: InChIKey=MAAZZBJBEAVPAT-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 = 50400042   

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
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM50400042 (CHEMBL2177728) Show SMILES COc1ccc(Nc2nc(nc3scnc23)N2CCC(C2)C(=O)Nc2ccc(cc2)C(O)=O)cc1OC Show InChI InChI=1S/C25H24N6O5S/c1-35-18-8-7-17(11-19(18)36-2)27-21-20-23(37-13-26-20)30-25(29-21)31-10-9-15(12-31)22(32)28-16-5-3-14(4-6-16)24(33)34/h3-8,11,13,15H,9-10,12H2,1-2H3,(H,28,32)(H,33,34)(H,27,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	93	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant spleen tyrosine kinase (360 to 635 amino acid residues) after 10 mins by scintillation counting analysis				J Med Chem 55: 10414-23 (2012) Article DOI: 10.1021/jm301367c BindingDB Entry DOI: 10.7270/Q2057H23
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