Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50043322   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50439334 (CHEMBL2419761) Show SMILES C1COc2cc3c(Nc4cccc(c4)-c4ccccc4)ncnc3cc2O1 Show InChI InChI=1S/C22H17N3O2/c1-2-5-15(6-3-1)16-7-4-8-17(11-16)25-22-18-12-20-21(27-10-9-26-20)13-19(18)23-14-24-22/h1-8,11-14H,9-10H2,(H,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
University of Padova Curated by ChEMBL					Assay Description Inhibition of Abl (unknown origin)				Eur J Med Chem 67: 373-83 (2013) Article DOI: 10.1016/j.ejmech.2013.06.057 BindingDB Entry DOI: 10.7270/Q2SN0BCC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50439335 (CHEMBL2419760) Show SMILES C1Oc2cc3ncnc(Nc4cccc(c4)-c4ccccc4)c3cc2O1 Show InChI InChI=1S/C21H15N3O2/c1-2-5-14(6-3-1)15-7-4-8-16(9-15)24-21-17-10-19-20(26-13-25-19)11-18(17)22-12-23-21/h1-12H,13H2,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
University of Padova Curated by ChEMBL					Assay Description Inhibition of Abl (unknown origin)				Eur J Med Chem 67: 373-83 (2013) Article DOI: 10.1016/j.ejmech.2013.06.057 BindingDB Entry DOI: 10.7270/Q2SN0BCC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50439333 (CHEMBL2419762) Show SMILES C1COc2cc3ncnc(Nc4cccc(c4)-c4ccccc4)c3cc2OC1 Show InChI InChI=1S/C23H19N3O2/c1-2-6-16(7-3-1)17-8-4-9-18(12-17)26-23-19-13-21-22(28-11-5-10-27-21)14-20(19)24-15-25-23/h1-4,6-9,12-15H,5,10-11H2,(H,24,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
University of Padova Curated by ChEMBL					Assay Description Inhibition of Abl (unknown origin)				Eur J Med Chem 67: 373-83 (2013) Article DOI: 10.1016/j.ejmech.2013.06.057 BindingDB Entry DOI: 10.7270/Q2SN0BCC
					More data for this Ligand-Target Pair