Compile Data Set for Download or QSAR

Found 6 hits with Last Name = 'di pillo' and Initial = 'f'   

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
Serine/threonine-protein kinase VRK1 (Homo sapiens (Human))	BDBM25017 (2-[(3,5-difluoro-4-hydroxyphenyl)amino]-5,7-dimeth...) Show SMILES CC(C)CCN1C(C)C(=O)N(C)c2cnc(Nc3cc(F)c(O)c(F)c3)nc12 Show InChI InChI=1S/C19H23F2N5O2/c1-10(2)5-6-26-11(3)18(28)25(4)15-9-22-19(24-17(15)26)23-12-7-13(20)16(27)14(21)8-12/h7-11,27H,5-6H2,1-4H3,(H,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Estadual de Campinas (UNICAMP) Curated by ChEMBL					Assay Description Inhibition of full length wild-type VRK1 (unknown origin) expressed in insect cells using ULight-Histone 3-Thr3 peptide as substrate incubated for 30...				ACS Med Chem Lett 10: 1266-1271 (2019) Article DOI: 10.1021/acsmedchemlett.9b00082 BindingDB Entry DOI: 10.7270/Q2BP061J
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase VRK1 (Homo sapiens (Human))	BDBM50502749 (CHEMBL4435359) Show SMILES Cc1ncc(cc1-c1cc(F)c(O)c(F)c1)-c1cc(F)c(O)c(F)c1 Show InChI InChI=1S/C18H11F4NO2/c1-8-12(10-5-15(21)18(25)16(22)6-10)2-11(7-23-8)9-3-13(19)17(24)14(20)4-9/h2-7,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Estadual de Campinas (UNICAMP) Curated by ChEMBL					Assay Description Inhibition of full length wild-type VRK1 (unknown origin) expressed in insect cells using ULight-Histone 3-Thr3 peptide as substrate incubated for 30...				ACS Med Chem Lett 10: 1266-1271 (2019) Article DOI: 10.1021/acsmedchemlett.9b00082 BindingDB Entry DOI: 10.7270/Q2BP061J
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase VRK1 (Homo sapiens (Human))	BDBM50502748 (CHEMBL4436323) Show SMILES Nc1ncc(cc1-c1cc(F)c(O)c(F)c1)-c1cc(F)c(O)c(F)c1 Show InChI InChI=1S/C17H10F4N2O2/c18-11-2-7(3-12(19)15(11)24)9-1-10(17(22)23-6-9)8-4-13(20)16(25)14(21)5-8/h1-6,24-25H,(H2,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Estadual de Campinas (UNICAMP) Curated by ChEMBL					Assay Description Inhibition of full length wild-type VRK1 (unknown origin) expressed in insect cells using ULight-Histone 3-Thr3 peptide as substrate incubated for 30...				ACS Med Chem Lett 10: 1266-1271 (2019) Article DOI: 10.1021/acsmedchemlett.9b00082 BindingDB Entry DOI: 10.7270/Q2BP061J
					More data for this Ligand-Target Pair				3D Structure (crystal)
Serine/threonine-protein kinase VRK1 (Homo sapiens (Human))	BDBM50502751 (CHEMBL4452098) Show SMILES Nc1ncc(cc1-c1cc(F)c(O)c(F)c1)-c1ccc2ncsc2c1 Show InChI InChI=1S/C18H11F2N3OS/c19-13-4-10(5-14(20)17(13)24)12-3-11(7-22-18(12)21)9-1-2-15-16(6-9)25-8-23-15/h1-8,24H,(H2,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	674	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Estadual de Campinas (UNICAMP) Curated by ChEMBL					Assay Description Inhibition of full length wild-type VRK1 (unknown origin) expressed in insect cells using ULight-Histone 3-Thr3 peptide as substrate incubated for 30...				ACS Med Chem Lett 10: 1266-1271 (2019) Article DOI: 10.1021/acsmedchemlett.9b00082 BindingDB Entry DOI: 10.7270/Q2BP061J
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase VRK1 (Homo sapiens (Human))	BDBM50502749 (CHEMBL4435359) Show SMILES Cc1ncc(cc1-c1cc(F)c(O)c(F)c1)-c1cc(F)c(O)c(F)c1 Show InChI InChI=1S/C18H11F4NO2/c1-8-12(10-5-15(21)18(25)16(22)6-10)2-11(7-23-8)9-3-13(19)17(24)14(20)4-9/h2-7,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a
Universidade Estadual de Campinas (UNICAMP) Curated by ChEMBL					Assay Description Binding affinity to recombinant full length N-terminal His-tagged VRK1 (unknown origin) (1 to 396 residues) expressed in Escherichia coli BL 21 DE3-R...				ACS Med Chem Lett 10: 1266-1271 (2019) Article DOI: 10.1021/acsmedchemlett.9b00082 BindingDB Entry DOI: 10.7270/Q2BP061J
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase VRK2 (Homo sapiens (Human))	BDBM50502750 (CHEMBL4467571) Show SMILES Nc1ncc(cc1-c1cc(F)c(O)c(F)c1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H13F2N3O3S/c18-14-6-10(7-15(19)16(14)23)13-5-11(8-22-17(13)20)9-1-3-12(4-2-9)26(21,24)25/h1-8,23H,(H2,20,22)(H2,21,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	n/a	401	n/a	n/a	n/a	n/a	n/a
Universidade Estadual de Campinas (UNICAMP) Curated by ChEMBL					Assay Description Binding affinity to recombinant N-terminal His-tagged VRK2 kinase domain (unknown origin) (14 to 335 residues) expressed in Escherichia coli BL 21 DE...				ACS Med Chem Lett 10: 1266-1271 (2019) Article DOI: 10.1021/acsmedchemlett.9b00082 BindingDB Entry DOI: 10.7270/Q2BP061J
					More data for this Ligand-Target Pair				3D Structure (crystal)