BDBM50414003 CHEMBL470925

SMILES: COc1cccc(c1)-c1cn(-c2ccc(CCNCCO)cc2)c2ncnc(N)c12

InChI Key: InChIKey=TYJIKBLDRFHCQM-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50414003   

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
Calmodulin/Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50414003 (CHEMBL470925) Show SMILES COc1cccc(c1)-c1cn(-c2ccc(CCNCCO)cc2)c2ncnc(N)c12 Show InChI InChI=1S/C23H25N5O2/c1-30-19-4-2-3-17(13-19)20-14-28(23-21(20)22(24)26-15-27-23)18-7-5-16(6-8-18)9-10-25-11-12-29/h2-8,13-15,25,29H,9-12H2,1H3,(H2,24,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of c-Src kinase (unknown origin)				Citation and Details Article DOI: 10.1007/s00044-012-0308-3 BindingDB Entry DOI: 10.7270/Q2BZ68ZH
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50414003 (CHEMBL470925) Show SMILES COc1cccc(c1)-c1cn(-c2ccc(CCNCCO)cc2)c2ncnc(N)c12 Show InChI InChI=1S/C23H25N5O2/c1-30-19-4-2-3-17(13-19)20-14-28(23-21(20)22(24)26-15-27-23)18-7-5-16(6-8-18)9-10-25-11-12-29/h2-8,13-15,25,29H,9-12H2,1H3,(H2,24,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19.9	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of c-Src				Eur J Med Chem 44: 990-1000 (2009) Article DOI: 10.1016/j.ejmech.2008.07.002 BindingDB Entry DOI: 10.7270/Q2ZC8434
					More data for this Ligand-Target Pair