null

SMILES: COc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1cccc2[nH]nc(N)c12

InChI Key: InChIKey=XZYNVPHYHRRQKH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50131065   

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
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50131065 (CHEMBL3634544) Show SMILES COc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1cccc2[nH]nc(N)c12 Show InChI InChI=1S/C24H23N5O3/c1-32-18-11-9-17(10-12-18)24(31)27-14-13-26-23(30)16-7-5-15(6-8-16)19-3-2-4-20-21(19)22(25)29-28-20/h2-12H,13-14H2,1H3,(H,26,30)(H,27,31)(H3,25,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
First Affiliated Hospital of Xi'an Jiaotong University Curated by ChEMBL					Assay Description Inhibitory concentration against interleukin-2 binding				Eur J Med Chem 104: 139-47 (2015) BindingDB Entry DOI: 10.7270/Q23B61Z7
					More data for this Ligand-Target Pair
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50131065 (CHEMBL3634544) Show SMILES COc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1cccc2[nH]nc(N)c12 Show InChI InChI=1S/C24H23N5O3/c1-32-18-11-9-17(10-12-18)24(31)27-14-13-26-23(30)16-7-5-15(6-8-16)19-3-2-4-20-21(19)22(25)29-28-20/h2-12H,13-14H2,1H3,(H,26,30)(H,27,31)(H3,25,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
First Affiliated Hospital of Xi'an Jiaotong University Curated by ChEMBL					Assay Description Inhibitory concentration against interleukin-2 binding				Eur J Med Chem 104: 139-47 (2015) BindingDB Entry DOI: 10.7270/Q23B61Z7
					More data for this Ligand-Target Pair