Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Dual specificity tyrosine-phosphorylation-regulated kinase 1A' and Ligand = 'BDBM50538837'   

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
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50538837 (CHEMBL4645393) Show SMILES CCOC(=O)c1cnc2ccc(nc2c1N[C@H]1CC[C@H](CN)CC1)-c1cc(Cl)c(O)c(Cl)c1 |r,wU:16.17,wD:19.21,(64.46,-8.98,;63.13,-8.22,;61.81,-8.99,;60.47,-8.22,;60.46,-6.68,;59.14,-9,;59.14,-10.55,;57.81,-11.32,;56.47,-10.56,;55.14,-11.33,;53.81,-10.57,;53.81,-9.02,;55.13,-8.25,;56.47,-9.02,;57.8,-8.24,;57.79,-6.7,;56.45,-5.94,;55.12,-6.71,;53.79,-5.95,;53.78,-4.41,;52.44,-3.65,;52.43,-2.12,;55.1,-3.63,;56.44,-4.4,;52.48,-8.25,;52.48,-6.71,;51.15,-5.94,;51.15,-4.4,;49.81,-6.71,;48.48,-5.94,;49.82,-8.26,;48.49,-9.04,;51.15,-9.02,)| Show InChI InChI=1S/C24H26Cl2N4O3/c1-2-33-24(32)16-12-28-20-8-7-19(14-9-17(25)23(31)18(26)10-14)30-22(20)21(16)29-15-5-3-13(11-27)4-6-15/h7-10,12-13,15,31H,2-6,11,27H2,1H3,(H,28,29)/t13-,15-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.220	n/a	n/a	n/a	n/a	n/a
Stanford University Curated by ChEMBL					Assay Description Binding affinity to wild-type human partial length DYRK1A (H129 to S509 residues) expressed in mammalian expression system by Kinomescan method				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115193 BindingDB Entry DOI: 10.7270/Q2ZC86FF
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50538837 (CHEMBL4645393) Show SMILES CCOC(=O)c1cnc2ccc(nc2c1N[C@H]1CC[C@H](CN)CC1)-c1cc(Cl)c(O)c(Cl)c1 |r,wU:16.17,wD:19.21,(64.46,-8.98,;63.13,-8.22,;61.81,-8.99,;60.47,-8.22,;60.46,-6.68,;59.14,-9,;59.14,-10.55,;57.81,-11.32,;56.47,-10.56,;55.14,-11.33,;53.81,-10.57,;53.81,-9.02,;55.13,-8.25,;56.47,-9.02,;57.8,-8.24,;57.79,-6.7,;56.45,-5.94,;55.12,-6.71,;53.79,-5.95,;53.78,-4.41,;52.44,-3.65,;52.43,-2.12,;55.1,-3.63,;56.44,-4.4,;52.48,-8.25,;52.48,-6.71,;51.15,-5.94,;51.15,-4.4,;49.81,-6.71,;48.48,-5.94,;49.82,-8.26,;48.49,-9.04,;51.15,-9.02,)| Show InChI InChI=1S/C24H26Cl2N4O3/c1-2-33-24(32)16-12-28-20-8-7-19(14-9-17(25)23(31)18(26)10-14)30-22(20)21(16)29-15-5-3-13(11-27)4-6-15/h7-10,12-13,15,31H,2-6,11,27H2,1H3,(H,28,29)/t13-,15-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a
Stanford University Curated by ChEMBL					Assay Description Inhibition of human DYRK1A transfected in HEK293T cells co-transfected with Renilla plasmid, pGL3-NFAT and NFATc1 assessed as derepression of NFAT-de...				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115193 BindingDB Entry DOI: 10.7270/Q2ZC86FF
					More data for this Ligand-Target Pair