Compile Data Set for Download or QSAR

Found 629 hits with Last Name = 'su' and Initial = 'mm'   

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
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50367489 (CHEMBL1269499) Show SMILES CCc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C11H15FN2O5/c1-2-5-3-14(11(18)13-9(5)17)10-7(12)8(16)6(4-15)19-10/h3,6-8,10,15-16H,2,4H2,1H3,(H,13,17,18)/t6-,7+,8-,10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -1				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50367488 (FIALURIDINE) Show SMILES OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)n1cc(I)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C9H10FIN2O5/c10-5-6(15)4(2-14)18-8(5)13-1-3(11)7(16)12-9(13)17/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5+,6-,8-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -2				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50367487 (CHEMBL475717) Show SMILES Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C10H13FN2O5/c1-4-2-13(10(17)12-8(4)16)9-6(11)7(15)5(3-14)18-9/h2,5-7,9,14-15H,3H2,1H3,(H,12,16,17)/t5-,6+,7-,9-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -1				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50367489 (CHEMBL1269499) Show SMILES CCc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C11H15FN2O5/c1-2-5-3-14(11(18)13-9(5)17)10-7(12)8(16)6(4-15)19-10/h3,6-8,10,15-16H,2,4H2,1H3,(H,13,17,18)/t6-,7+,8-,10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -2				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50367488 (FIALURIDINE) Show SMILES OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)n1cc(I)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C9H10FIN2O5/c10-5-6(15)4(2-14)18-8(5)13-1-3(11)7(16)12-9(13)17/h1,4-6,8,14-15H,2H2,(H,12,16,17)/t4-,5+,6-,8-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	PubMed	950	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -2				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50367487 (CHEMBL475717) Show SMILES Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C10H13FN2O5/c1-4-2-13(10(17)12-8(4)16)9-6(11)7(15)5(3-14)18-9/h2,5-7,9,14-15H,3H2,1H3,(H,12,16,17)/t5-,6+,7-,9-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -1				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50282061 (1-((2R,4S,5R)-5-Ethynyl-4-hydroxy-tetrahydro-furan...) Show SMILES Cc1cn([C@H]2C[C@H](O)[C@H](O2)C#C)c(=O)[nH]c1=O Show InChI InChI=1S/C11H12N2O4/c1-3-8-7(14)4-9(17-8)13-5-6(2)10(15)12-11(13)16/h1,5,7-9,14H,4H2,2H3,(H,12,15,16)/t7-,8+,9+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity of the compound against HSV-1 Thymidine kinase				Bioorg Med Chem Lett 3: 1571-1576 (1993) Article DOI: 10.1016/S0960-894X(00)80020-7 BindingDB Entry DOI: 10.7270/Q28P60F3
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50282067 (1-((2R,4S,5S)-4-Hydroxy-5-methoxy-tetrahydro-furan...) Show SMILES CO[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(=O)[nH]c1=O Show InChI InChI=1S/C10H14N2O5/c1-5-4-12(10(15)11-8(5)14)7-3-6(13)9(16-2)17-7/h4,6-7,9,13H,3H2,1-2H3,(H,11,14,15)/t6-,7+,9-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity of the compound against HSV-1 Thymidine kinase				Bioorg Med Chem Lett 3: 1571-1576 (1993) Article DOI: 10.1016/S0960-894X(00)80020-7 BindingDB Entry DOI: 10.7270/Q28P60F3
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50282063 (1-[(2R,4S,5S)-4-Hydroxy-5-(3-phenyl-propoxy)-tetra...) Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@H](OCCCc3ccccc3)O2)c(=O)[nH]c1=O Show InChI InChI=1S/C18H22N2O5/c1-12-11-20(18(23)19-16(12)22)15-10-14(21)17(25-15)24-9-5-8-13-6-3-2-4-7-13/h2-4,6-7,11,14-15,17,21H,5,8-10H2,1H3,(H,19,22,23)/t14-,15+,17-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity of the compound against HSV-1 Thymidine kinase				Bioorg Med Chem Lett 3: 1571-1576 (1993) Article DOI: 10.1016/S0960-894X(00)80020-7 BindingDB Entry DOI: 10.7270/Q28P60F3
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50282072 (1-((2R,4S,5S)-4-Hydroxy-5-phenethyloxy-tetrahydro-...) Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@H](OCCc3ccccc3)O2)c(=O)[nH]c1=O Show InChI InChI=1S/C17H20N2O5/c1-11-10-19(17(22)18-15(11)21)14-9-13(20)16(24-14)23-8-7-12-5-3-2-4-6-12/h2-6,10,13-14,16,20H,7-9H2,1H3,(H,18,21,22)/t13-,14+,16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity of the compound against HSV-1 Thymidine kinase				Bioorg Med Chem Lett 3: 1571-1576 (1993) Article DOI: 10.1016/S0960-894X(00)80020-7 BindingDB Entry DOI: 10.7270/Q28P60F3
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50021776 (2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9-dihydro-pur...) Show SMILES Nc1nc2n(COCCO)cnc2c(=O)[nH]1 Show InChI InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -1				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Thymidine kinase, cytosolic (Homo sapiens (Human))	BDBM50021776 (2-Amino-9-(2-hydroxy-ethoxymethyl)-5,9-dihydro-pur...) Show SMILES Nc1nc2n(COCCO)cnc2c(=O)[nH]1 Show InChI InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was evaluated for Kinetic constant for viral thymidine kinase of Herpes simplex virus (HSV) -2				J Med Chem 30: 867-71 (1987) BindingDB Entry DOI: 10.7270/Q2Z32077
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50468557 (CHEMBL4294787) Show SMILES S=C(Nc1ccccc1)N1N=C(CC1c1ccc2OCCOc2c1)c1ccc(OCc2ccccc2)cc1 |c:11| Show InChI InChI=1S/C31H27N3O3S/c38-31(32-25-9-5-2-6-10-25)34-28(24-13-16-29-30(19-24)36-18-17-35-29)20-27(33-34)23-11-14-26(15-12-23)37-21-22-7-3-1-4-8-22/h1-16,19,28H,17-18,20-21H2,(H,32,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of mouse full length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 155: 725-735 (2018) Article DOI: 10.1016/j.ejmech.2018.06.043 BindingDB Entry DOI: 10.7270/Q2639SF8
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022107 (CHEMBL3298226) Show SMILES COc1cccc2ccnc(NCC(C)(C)c3ccccc3)c12 Show InChI InChI=1S/C20H22N2O/c1-20(2,16-9-5-4-6-10-16)14-22-19-18-15(12-13-21-19)8-7-11-17(18)23-3/h4-13H,14H2,1-3H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022108 (CHEMBL3298228) Show SMILES COc1cccc2nc(O)nc(NCC(C)(C)c3ccccc3)c12 Show InChI InChI=1S/C19H21N3O2/c1-19(2,13-8-5-4-6-9-13)12-20-17-16-14(21-18(23)22-17)10-7-11-15(16)24-3/h4-11H,12H2,1-3H3,(H2,20,21,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022109 (CHEMBL3298224) Show SMILES CCc1cccc2snc(NCC(C)(C)c3ccccc3)c12 Show InChI InChI=1S/C19H22N2S/c1-4-14-9-8-12-16-17(14)18(21-22-16)20-13-19(2,3)15-10-6-5-7-11-15/h5-12H,4,13H2,1-3H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50396483 (PLX-4032 | RG 7204 | Ro 5185426 | US10570155, Vemu...) Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F Show InChI InChI=1S/C23H18ClF2N3O3S/c1-2-9-33(31,32)29-19-8-7-18(25)20(21(19)26)22(30)17-12-28-23-16(17)10-14(11-27-23)13-3-5-15(24)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of mouse full length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 155: 725-735 (2018) Article DOI: 10.1016/j.ejmech.2018.06.043 BindingDB Entry DOI: 10.7270/Q2639SF8
					More data for this Ligand-Target Pair				3D Structure (crystal)
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430217 (CHEMBL2331989) Show SMILES CC1=Nc2ccnn2[C@@H](C1c1ncnn1C1CCCC1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C20H20Cl2N6/c1-12-18(20-23-11-25-27(20)14-4-2-3-5-14)19(28-17(26-12)8-9-24-28)13-6-7-15(21)16(22)10-13/h6-11,14,18-19H,2-5H2,1H3/t18?,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022110 (CHEMBL3298140) Show SMILES COc1cccc2onc(NCC(C)(C)c3ccccc3)c12 Show InChI InChI=1S/C18H20N2O2/c1-18(2,13-8-5-4-6-9-13)12-19-17-16-14(21-3)10-7-11-15(16)22-20-17/h4-11H,12H2,1-3H3,(H,19,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430216 (CHEMBL2331990) Show SMILES CC1=Nc2ccnn2[C@@H](C1c1ncnn1C1CCC1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C19H18Cl2N6/c1-11-17(19-22-10-24-26(19)13-3-2-4-13)18(27-16(25-11)7-8-23-27)12-5-6-14(20)15(21)9-12/h5-10,13,17-18H,2-4H2,1H3/t17?,18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50468570 (CHEMBL4290513) Show SMILES Brc1ccc(cc1)C1=NN(C(C1)c1ccc2OCCOc2c1)C(=S)Nc1ccccc1 |t:8| Show InChI InChI=1S/C24H20BrN3O2S/c25-18-9-6-16(7-10-18)20-15-21(17-8-11-22-23(14-17)30-13-12-29-22)28(27-20)24(31)26-19-4-2-1-3-5-19/h1-11,14,21H,12-13,15H2,(H,26,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of mouse full length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 155: 725-735 (2018) Article DOI: 10.1016/j.ejmech.2018.06.043 BindingDB Entry DOI: 10.7270/Q2639SF8
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430219 (CHEMBL2331987) Show SMILES CC1=Nc2ccnn2[C@@H](C1c1ncnn1C1CCCCC1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C21H22Cl2N6/c1-13-19(21-24-12-26-28(21)15-5-3-2-4-6-15)20(29-18(27-13)9-10-25-29)14-7-8-16(22)17(23)11-14/h7-12,15,19-20H,2-6H2,1H3/t19?,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50468565 (CHEMBL4277125) Show SMILES COc1cccc(c1)C1=NN(C(C1)c1ccc2OCCOc2c1)C(=S)Nc1ccccc1 |t:9| Show InChI InChI=1S/C25H23N3O3S/c1-29-20-9-5-6-17(14-20)21-16-22(18-10-11-23-24(15-18)31-13-12-30-23)28(27-21)25(32)26-19-7-3-2-4-8-19/h2-11,14-15,22H,12-13,16H2,1H3,(H,26,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of mouse full length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 155: 725-735 (2018) Article DOI: 10.1016/j.ejmech.2018.06.043 BindingDB Entry DOI: 10.7270/Q2639SF8
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022111 (CHEMBL3298227) Show SMILES COc1cccc2nc(Cl)nc(NCC(C)(C)c3ccccc3)c12 Show InChI InChI=1S/C19H20ClN3O/c1-19(2,13-8-5-4-6-9-13)12-21-17-16-14(22-18(20)23-17)10-7-11-15(16)24-3/h4-11H,12H2,1-3H3,(H,21,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430227 (CHEMBL2332455) Show SMILES CC1=Nc2ccnn2[C@@H](C1c1ncnn1-c1ccccc1F)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C21H15Cl2FN6/c1-12-19(21-25-11-27-29(21)17-5-3-2-4-16(17)24)20(30-18(28-12)8-9-26-30)13-6-7-14(22)15(23)10-13/h2-11,19-20H,1H3/t19?,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	74	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430225 (CHEMBL2332457) Show SMILES CC1=Nc2ccnn2[C@@H](C1c1ncnn1-c1ccc(C)cc1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C22H18Cl2N6/c1-13-3-6-16(7-4-13)29-22(25-12-27-29)20-14(2)28-19-9-10-26-30(19)21(20)15-5-8-17(23)18(24)11-15/h3-12,20-21H,1-2H3/t20?,21-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022112 (CHEMBL3298230) Show SMILES CCc1cccc2C(=O)N=C(NCC(C)(C)c3ccccc3)c12 |t:9| Show InChI InChI=1S/C20H22N2O/c1-4-14-9-8-12-16-17(14)18(22-19(16)23)21-13-20(2,3)15-10-6-5-7-11-15/h5-12H,4,13H2,1-3H3,(H,21,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430201 (CHEMBL2332448) Show SMILES COc1cccc(n1)-n1ncnc1C1[C@@H](c2ccc(Cl)c(Cl)c2)n2nc(cc2N=C1C)C(F)(F)F |r,c:32| Show InChI InChI=1S/C22H16Cl2F3N7O/c1-11-19(21-28-10-29-34(21)16-4-3-5-18(31-16)35-2)20(12-6-7-13(23)14(24)8-12)33-17(30-11)9-15(32-33)22(25,26)27/h3-10,19-20H,1-2H3/t19?,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50022113 (CHEMBL3298231) Show SMILES CCNC(=O)O[C@H]1CC[C@@](CNc2nn(C)c3cccc(OC)c23)(CC1)c1ccccc1 |r,wU:9.9,6.5,(16.91,-27.75,;15.56,-28.49,;14.24,-27.7,;12.89,-28.44,;12.86,-29.98,;11.58,-27.64,;11.61,-26.1,;10.29,-25.3,;10.33,-23.76,;11.68,-23.02,;13.02,-22.27,;14.34,-23.07,;15.69,-22.32,;15.68,-20.79,;17.13,-20.3,;17.6,-18.82,;18.04,-21.53,;19.58,-21.69,;20.22,-23.1,;19.31,-24.35,;17.78,-24.19,;16.88,-25.44,;17.51,-26.85,;17.15,-22.78,;13,-23.81,;12.96,-25.35,;10.36,-22.23,;10.4,-20.69,;9.08,-19.9,;7.73,-20.64,;7.71,-22.19,;9.02,-22.98,)| Show InChI InChI=1S/C25H32N4O3/c1-4-26-24(30)32-19-13-15-25(16-14-19,18-9-6-5-7-10-18)17-27-23-22-20(29(2)28-23)11-8-12-21(22)31-3/h5-12,19H,4,13-17H2,1-3H3,(H,26,30)(H,27,28)/t19-,25-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human Kv1.5 expressed in mouse L929 cells assessed as inhibition of current				Bioorg Med Chem Lett 24: 3018-22 (2014) Article DOI: 10.1016/j.bmcl.2014.05.035 BindingDB Entry DOI: 10.7270/Q2HH6MNP
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430220 (CHEMBL2331986) Show SMILES CC(C)n1ncnc1C1[C@@H](c2ccc(Cl)c(Cl)c2)n2nccc2N=C1C |r,c:26| Show InChI InChI=1S/C18H18Cl2N6/c1-10(2)25-18(21-9-23-25)16-11(3)24-15-6-7-22-26(15)17(16)12-4-5-13(19)14(20)8-12/h4-10,16-17H,1-3H3/t16?,17-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430211 (CHEMBL2331996) Show SMILES Cc1cc2N=C(C)C([C@@H](c3ccc(Cl)c(Cl)c3)n2n1)c1ncnn1C1CCC1 |r,t:4| Show InChI InChI=1S/C20H20Cl2N6/c1-11-8-17-25-12(2)18(20-23-10-24-27(20)14-4-3-5-14)19(28(17)26-11)13-6-7-15(21)16(22)9-13/h6-10,14,18-19H,3-5H2,1-2H3/t18?,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430206 (CHEMBL2332443) Show SMILES CC1=Nc2cc(nn2[C@@H](C1c1ncnn1-c1cccc(n1)C(F)(F)F)c1ccc(Cl)c(Cl)c1)C(F)(F)F |r,t:1| Show InChI InChI=1S/C22H13Cl2F6N7/c1-10-18(20-31-9-32-37(20)16-4-2-3-14(34-16)21(25,26)27)19(11-5-6-12(23)13(24)7-11)36-17(33-10)8-15(35-36)22(28,29)30/h2-9,18-19H,1H3/t18?,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430228 (CHEMBL2332454) Show SMILES CC1=Nc2ccnn2[C@@H](C1c1ncnn1-c1cccc(F)c1)c1ccc(Cl)c(Cl)c1 |r,t:1| Show InChI InChI=1S/C21H15Cl2FN6/c1-12-19(21-25-11-27-29(21)15-4-2-3-14(24)10-15)20(30-18(28-12)7-8-26-30)13-5-6-16(22)17(23)9-13/h2-11,19-20H,1H3/t19?,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5 (Homo sapiens (Human))	BDBM50430197 (CHEMBL2332452) Show SMILES CCOCCn1ccnc1C1[C@@H](c2ccc(Cl)c(Cl)c2)n2nc(cc2N=C1C)C(F)(F)F |r,c:28| Show InChI InChI=1S/C21H20Cl2F3N5O/c1-3-32-9-8-30-7-6-27-20(30)18-12(2)28-17-11-16(21(24,25)26)29-31(17)19(18)13-4-5-14(22)15(23)10-13/h4-7,10-11,18-19H,3,8-9H2,1-2H3/t18?,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Antagonist activity at human Kv1.5 expressed in mouse L929 cells assessed as inhibition of delayed rectifier repolarization current by patch clamp as...				Bioorg Med Chem Lett 23: 1743-7 (2013) Article DOI: 10.1016/j.bmcl.2013.01.064 BindingDB Entry DOI: 10.7270/Q2QN685H
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461294 (US10774068, Example 1 | US11427560, Example 1) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ncccc4C)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H33ClN6O3/c1-5-40-29-16-25-23(15-26(29)37-30(39)9-7-13-38(3)4)31(21(17-33)18-35-25)36-22-10-11-28(24(32)14-22)41-19-27-20(2)8-6-12-34-27/h6,8,10-12,14-16,18H,5,7,9,13,19H2,1-4H3,(H,35,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461294 (US10774068, Example 1 | US11427560, Example 1) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ncccc4C)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H33ClN6O3/c1-5-40-29-16-25-23(15-26(29)37-30(39)9-7-13-38(3)4)31(21(17-33)18-35-25)36-22-10-11-28(24(32)14-22)41-19-27-20(2)8-6-12-34-27/h6,8,10-12,14-16,18H,5,7,9,13,19H2,1-4H3,(H,35,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461295 (US10774068, Example 2 | US11427560, Example 2) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cc(Cl)ccn4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30Cl2N6O3/c1-4-40-28-15-25-23(14-26(28)37-29(39)6-5-11-38(2)3)30(19(16-33)17-35-25)36-21-7-8-27(24(32)13-21)41-18-22-12-20(31)9-10-34-22/h7-10,12-15,17H,4-6,11,18H2,1-3H3,(H,35,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461295 (US10774068, Example 2 | US11427560, Example 2) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cc(Cl)ccn4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30Cl2N6O3/c1-4-40-28-15-25-23(14-26(28)37-29(39)6-5-11-38(2)3)30(19(16-33)17-35-25)36-21-7-8-27(24(32)13-21)41-18-22-12-20(31)9-10-34-22/h7-10,12-15,17H,4-6,11,18H2,1-3H3,(H,35,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461296 (US10774068, Example 3 | US11427560, Example 3) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Br)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30BrClN6O3/c1-4-40-27-15-24-22(14-25(27)37-29(39)9-6-12-38(2)3)30(19(16-33)17-34-24)36-20-10-11-26(23(32)13-20)41-18-21-7-5-8-28(31)35-21/h5,7-8,10-11,13-15,17H,4,6,9,12,18H2,1-3H3,(H,34,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461296 (US10774068, Example 3 | US11427560, Example 3) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Br)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30BrClN6O3/c1-4-40-27-15-24-22(14-25(27)37-29(39)9-6-12-38(2)3)30(19(16-33)17-34-24)36-20-10-11-26(23(32)13-20)41-18-21-7-5-8-28(31)35-21/h5,7-8,10-11,13-15,17H,4,6,9,12,18H2,1-3H3,(H,34,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461297 (US10774068, Example 4 | US11427560, Example 4) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(F)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30ClFN6O3/c1-4-40-27-15-24-22(14-25(27)37-29(39)9-6-12-38(2)3)30(19(16-33)17-34-24)36-20-10-11-26(23(31)13-20)41-18-21-7-5-8-28(32)35-21/h5,7-8,10-11,13-15,17H,4,6,9,12,18H2,1-3H3,(H,34,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461297 (US10774068, Example 4 | US11427560, Example 4) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(F)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30ClFN6O3/c1-4-40-27-15-24-22(14-25(27)37-29(39)9-6-12-38(2)3)30(19(16-33)17-34-24)36-20-10-11-26(23(31)13-20)41-18-21-7-5-8-28(32)35-21/h5,7-8,10-11,13-15,17H,4,6,9,12,18H2,1-3H3,(H,34,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461298 (US10774068, Example 5 | US11427560, Example 5) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(n4)C#N)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H30ClN7O3/c1-4-41-29-15-26-24(14-27(29)38-30(40)9-6-12-39(2)3)31(20(16-33)18-35-26)37-21-10-11-28(25(32)13-21)42-19-23-8-5-7-22(17-34)36-23/h5,7-8,10-11,13-15,18H,4,6,9,12,19H2,1-3H3,(H,35,37)(H,38,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461300 (US10774068, Example 7 | US11427560, Example 7) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Cl)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30Cl2N6O3/c1-4-40-27-15-24-22(14-25(27)37-29(39)9-6-12-38(2)3)30(19(16-33)17-34-24)36-20-10-11-26(23(31)13-20)41-18-21-7-5-8-28(32)35-21/h5,7-8,10-11,13-15,17H,4,6,9,12,18H2,1-3H3,(H,34,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461300 (US10774068, Example 7 | US11427560, Example 7) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Cl)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H30Cl2N6O3/c1-4-40-27-15-24-22(14-25(27)37-29(39)9-6-12-38(2)3)30(19(16-33)17-34-24)36-20-10-11-26(23(31)13-20)41-18-21-7-5-8-28(32)35-21/h5,7-8,10-11,13-15,17H,4,6,9,12,18H2,1-3H3,(H,34,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461301 (US10774068, Example 107 | US10774068, Example 8 | ...) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C30H31ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-6,8,10-12,14-16,18H,4,7,9,13,19H2,1-3H3,(H,34,35)(H,36,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461304 (US10774068, Example 10 | US11427560, Example 10) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cc(C)ccn4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H33ClN6O3/c1-5-40-29-16-26-24(15-27(29)37-30(39)7-6-12-38(3)4)31(21(17-33)18-35-26)36-22-8-9-28(25(32)14-22)41-19-23-13-20(2)10-11-34-23/h8-11,13-16,18H,5-7,12,19H2,1-4H3,(H,35,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461305 (US10774068, Example 11 | US11427560, Example 11) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccc(C)cn4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H33ClN6O3/c1-5-40-29-15-26-24(14-27(29)37-30(39)7-6-12-38(3)4)31(21(16-33)18-35-26)36-22-10-11-28(25(32)13-22)41-19-23-9-8-20(2)17-34-23/h8-11,13-15,17-18H,5-7,12,19H2,1-4H3,(H,35,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 4 (Homo sapiens (Human))	BDBM461306 (US10774068, Example 12 | US11427560, Example 12) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(C)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H33ClN6O3/c1-5-40-29-16-26-24(15-27(29)37-30(39)10-7-13-38(3)4)31(21(17-33)18-34-26)36-22-11-12-28(25(32)14-22)41-19-23-9-6-8-20(2)35-23/h6,8-9,11-12,14-16,18H,5,7,10,13,19H2,1-4H3,(H,34,36)(H,37,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM461306 (US10774068, Example 12 | US11427560, Example 12) Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(C)n4)c(Cl)c3)c2cc1NC(=O)CCCN(C)C Show InChI InChI=1S/C31H33ClN6O3/c1-5-40-29-16-26-24(15-27(29)37-30(39)10-7-13-38(3)4)31(21(17-33)18-34-26)36-22-11-12-28(25(32)14-22)41-19-23-9-6-8-20(2)35-23/h6,8-9,11-12,14-16,18H,5,7,10,13,19H2,1-4H3,(H,34,36)(H,37,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
THE SCRIPPS RESEARCH INSTITUTE; UNIVERSITÄT BREMEN US Patent					Assay Description MST1 and MST2 biochemical LanthaScreen Eu Kinase Binding Assay was based on the binding and displacement of kinase tracer to the kinase of interest. ...				US Patent US10774068 (2020) BindingDB Entry DOI: 10.7270/Q2S46W22
					More data for this Ligand-Target Pair

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