Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'ALK tyrosine kinase receptor' and Ligand = 'BDBM50018817'   

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
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM50018817 (CHEMBL3128060) Show SMILES C[C@@H](Oc1cc(cnc1N)-c1cnnn1C)c1cc(F)ccc1-n1nccn1 |r| Show InChI InChI=1S/C18H17FN8O/c1-11(14-8-13(19)3-4-15(14)27-23-5-6-24-27)28-17-7-12(9-21-18(17)20)16-10-22-25-26(16)2/h3-11H,1-2H3,(H2,20,21)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of wild type human recombinant ALK kinase domain (amino acids 1093 to 1141) expressed in baculovirus system using 5'FAM-KKSRGDYMTMQIG-CONH...				J Med Chem 57: 4720-44 (2014) Article DOI: 10.1021/jm500261q BindingDB Entry DOI: 10.7270/Q2K35W68
					More data for this Ligand-Target Pair
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM50018817 (CHEMBL3128060) Show SMILES C[C@@H](Oc1cc(cnc1N)-c1cnnn1C)c1cc(F)ccc1-n1nccn1 |r| Show InChI InChI=1S/C18H17FN8O/c1-11(14-8-13(19)3-4-15(14)27-23-5-6-24-27)28-17-7-12(9-21-18(17)20)16-10-22-25-26(16)2/h3-11H,1-2H3,(H2,20,21)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant ALK L1196M mutant kinase domain (amino acids 1093 to 1141) expressed in baculovirus system using 5'FAM-KKSRGDYMTMQIG-...				J Med Chem 57: 4720-44 (2014) Article DOI: 10.1021/jm500261q BindingDB Entry DOI: 10.7270/Q2K35W68
					More data for this Ligand-Target Pair
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM50018817 (CHEMBL3128060) Show SMILES C[C@@H](Oc1cc(cnc1N)-c1cnnn1C)c1cc(F)ccc1-n1nccn1 |r| Show InChI InChI=1S/C18H17FN8O/c1-11(14-8-13(19)3-4-15(14)27-23-5-6-24-27)28-17-7-12(9-21-18(17)20)16-10-22-25-26(16)2/h3-11H,1-2H3,(H2,20,21)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	249	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of wild type human EML4-fused ALK expressed in mouse NIH-3T3 cells assessed as phosphorylated ALK level after 1 hr by sandwich ELISA				J Med Chem 57: 4720-44 (2014) Article DOI: 10.1021/jm500261q BindingDB Entry DOI: 10.7270/Q2K35W68
					More data for this Ligand-Target Pair
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM50018817 (CHEMBL3128060) Show SMILES C[C@@H](Oc1cc(cnc1N)-c1cnnn1C)c1cc(F)ccc1-n1nccn1 |r| Show InChI InChI=1S/C18H17FN8O/c1-11(14-8-13(19)3-4-15(14)27-23-5-6-24-27)28-17-7-12(9-21-18(17)20)16-10-22-25-26(16)2/h3-11H,1-2H3,(H2,20,21)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human EML4-fused ALK L1196M mutant expressed in mouse NIH-3T3 cells assessed as phospho-ALK level after 1 hr by sandwich ELISA				J Med Chem 57: 4720-44 (2014) Article DOI: 10.1021/jm500261q BindingDB Entry DOI: 10.7270/Q2K35W68
					More data for this Ligand-Target Pair