BDBM50375367 CHEMBL405893

SMILES: COc1cc(Nc2nn3c(N[C@@H](CO)C(C)C)cc(nc3c2C(N)=O)C(C)C)cc(OC)c1

InChI Key: InChIKey=SIWSCMGABNJOIC-SFHVURJKSA-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 = 50375367   

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
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50375367 (CHEMBL405893) Show SMILES COc1cc(Nc2nn3c(N[C@@H](CO)C(C)C)cc(nc3c2C(N)=O)C(C)C)cc(OC)c1 Show InChI InChI=1S/C23H32N6O4/c1-12(2)17-10-19(26-18(11-30)13(3)4)29-23(27-17)20(21(24)31)22(28-29)25-14-7-15(32-5)9-16(8-14)33-6/h7-10,12-13,18,26,30H,11H2,1-6H3,(H2,24,31)(H,25,28)/t18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Kissei Pharmaceutical Company Ltd Curated by ChEMBL					Assay Description Inhibition of human cSrc				Bioorg Med Chem 16: 909-21 (2008) Article DOI: 10.1016/j.bmc.2007.10.068 BindingDB Entry DOI: 10.7270/Q2CF9R01
					More data for this Ligand-Target Pair