Compile Data Set for Download or QSAR

Found 87 hits with Last Name = 'yu' and Initial = 'sm'   

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
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568146 (CHEMBL1481541) Show SMILES COc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Noncompetitive inhibition of mushroom tyrosinase assessed as dissociation constant using L-DOPA as substrate by Lineweaver-Burk plot analysis				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490888 (CHEMBL2347725) Show SMILES COc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCN(C)CC3)sc2c1 Show InChI InChI=1S/C22H27N5O2S/c1-26-11-13-27(14-12-26)10-9-23-21(28)25-22-24-18-8-7-16(15-20(18)30-22)17-5-3-4-6-19(17)29-2/h3-8,15H,9-14H2,1-2H3,(H2,23,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.0150	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490916 (CHEMBL2347722) Show SMILES COc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCOCC3)sc2c1 Show InChI InChI=1S/C21H24N4O3S/c1-27-18-5-3-2-4-16(18)15-6-7-17-19(14-15)29-21(23-17)24-20(26)22-8-9-25-10-12-28-13-11-25/h2-7,14H,8-13H2,1H3,(H2,22,23,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.0210	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490889 (CHEMBL2347723) Show SMILES COc1ccccc1-c1ccc2nc(NC(=O)NCCO)sc2c1 Show InChI InChI=1S/C17H17N3O3S/c1-23-14-5-3-2-4-12(14)11-6-7-13-15(10-11)24-17(19-13)20-16(22)18-8-9-21/h2-7,10,21H,8-9H2,1H3,(H2,18,19,20,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.0640	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490895 (CHEMBL2347711) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccccc1OCC Show InChI InChI=1S/C18H19N3O2S/c1-3-19-17(22)21-18-20-14-10-9-12(11-16(14)24-18)13-7-5-6-8-15(13)23-4-2/h5-11H,3-4H2,1-2H3,(H2,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.0640	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490918 (CHEMBL2347710) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccccc1OC Show InChI InChI=1S/C17H17N3O2S/c1-3-18-16(21)20-17-19-13-9-8-11(10-15(13)23-17)12-6-4-5-7-14(12)22-2/h4-10H,3H2,1-2H3,(H2,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490890 (CHEMBL2347719) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccc(N)cc1OC Show InChI InChI=1S/C17H18N4O2S/c1-3-19-16(22)21-17-20-13-7-4-10(8-15(13)24-17)12-6-5-11(18)9-14(12)23-2/h4-9H,3,18H2,1-2H3,(H2,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490932 (CHEMBL2347729) Show SMILES CCOc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCNCC3)sc2c1 Show InChI InChI=1S/C22H27N5O2S/c1-2-29-19-6-4-3-5-17(19)16-7-8-18-20(15-16)30-22(25-18)26-21(28)24-11-14-27-12-9-23-10-13-27/h3-8,15,23H,2,9-14H2,1H3,(H2,24,25,26,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.120	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490886 (CHEMBL2347728) Show SMILES CCOc1ccccc1-c1ccc2nc(NC(=O)NCCCO)sc2c1 Show InChI InChI=1S/C19H21N3O3S/c1-2-25-16-7-4-3-6-14(16)13-8-9-15-17(12-13)26-19(21-15)22-18(24)20-10-5-11-23/h3-4,6-9,12,23H,2,5,10-11H2,1H3,(H2,20,21,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.130	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490908 (CHEMBL2347724) Show SMILES COc1ccccc1-c1ccc2nc(NC(=O)NCCCO)sc2c1 Show InChI InChI=1S/C18H19N3O3S/c1-24-15-6-3-2-5-13(15)12-7-8-14-16(11-12)25-18(20-14)21-17(23)19-9-4-10-22/h2-3,5-8,11,22H,4,9-10H2,1H3,(H2,19,20,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.160	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490915 (CHEMBL2347727) Show SMILES CCOc1ccccc1-c1ccc2nc(NC(=O)NCCO)sc2c1 Show InChI InChI=1S/C18H19N3O3S/c1-2-24-15-6-4-3-5-13(15)12-7-8-14-16(11-12)25-18(20-14)21-17(23)19-9-10-22/h3-8,11,22H,2,9-10H2,1H3,(H2,19,20,21,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.180	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490887 (CHEMBL2347726) Show SMILES CCOc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCOCC3)sc2c1 Show InChI InChI=1S/C22H26N4O3S/c1-2-29-19-6-4-3-5-17(19)16-7-8-18-20(15-16)30-22(24-18)25-21(27)23-9-10-26-11-13-28-14-12-26/h3-8,15H,2,9-14H2,1H3,(H2,23,24,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490923 (CHEMBL2347716) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccccc1 Show InChI InChI=1S/C16H15N3OS/c1-2-17-15(20)19-16-18-13-9-8-12(10-14(13)21-16)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H2,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.310	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490929 (CHEMBL2347721) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccncc1OC Show InChI InChI=1S/C16H16N4O2S/c1-3-18-15(21)20-16-19-12-5-4-10(8-14(12)23-16)11-6-7-17-9-13(11)22-2/h4-9H,3H2,1-2H3,(H2,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.510	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50322535 (3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N...) Show SMILES CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4cccnn34)cc2C(F)(F)F)CC1 Show InChI InChI=1S/C29H27F3N6O/c1-20-5-6-22(16-21(20)8-10-25-18-33-27-4-3-11-34-38(25)27)28(39)35-24-9-7-23(26(17-24)29(30,31)32)19-37-14-12-36(2)13-15-37/h3-7,9,11,16-18H,12-15,19H2,1-2H3,(H,35,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	0.580	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair				3D Structure (crystal)
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490933 (CHEMBL2347731) Show SMILES CCc1ccccc1-c1ccc2nc(NC(=O)NCCN(C)C)sc2c1 Show InChI InChI=1S/C20H24N4OS/c1-4-14-7-5-6-8-16(14)15-9-10-17-18(13-15)26-20(22-17)23-19(25)21-11-12-24(2)3/h5-10,13H,4,11-12H2,1-3H3,(H2,21,22,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.770	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490885 (CHEMBL2347730) Show SMILES CCc1ccccc1-c1ccc2nc(NC(=O)NCCN3CCOCC3)sc2c1 Show InChI InChI=1S/C22H26N4O2S/c1-2-16-5-3-4-6-18(16)17-7-8-19-20(15-17)29-22(24-19)25-21(27)23-9-10-26-11-13-28-14-12-26/h3-8,15H,2,9-14H2,1H3,(H2,23,24,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.890	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490912 (CHEMBL2347720) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccc(OC)cc1OC Show InChI InChI=1S/C18H19N3O3S/c1-4-19-17(22)21-18-20-14-8-5-11(9-16(14)25-18)13-7-6-12(23-2)10-15(13)24-3/h5-10H,4H2,1-3H3,(H2,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490891 (CHEMBL2347717) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccncc1 Show InChI InChI=1S/C15H14N4OS/c1-2-17-14(20)19-15-18-12-4-3-11(9-13(12)21-15)10-5-7-16-8-6-10/h3-9H,2H2,1H3,(H2,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490903 (CHEMBL2347741) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccccc1OCC Show InChI InChI=1S/C18H20N4O2/c1-3-19-18(23)22-17-20-14-10-9-12(11-15(14)21-17)13-7-5-6-8-16(13)24-4-2/h5-11H,3-4H2,1-2H3,(H3,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490927 (CHEMBL2347713) Show SMILES CCCOc1ccccc1-c1ccc2nc(NC(=O)NCC)sc2c1 Show InChI InChI=1S/C19H21N3O2S/c1-3-11-24-16-8-6-5-7-14(16)13-9-10-15-17(12-13)25-19(21-15)22-18(23)20-4-2/h5-10,12H,3-4,11H2,1-2H3,(H2,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM286099 (N-(5-(ethylsulfonyl)-5-azaspiro[2.4]heptan-7-yl)-N...) Show SMILES CCS(=O)(=O)N1CC(N(C)c2ncnc3[nH]ccc23)C2(CC2)C1 Show InChI InChI=1S/C15H21N5O2S/c1-3-23(21,22)20-8-12(15(9-20)5-6-15)19(2)14-11-4-7-16-13(11)17-10-18-14/h4,7,10,12H,3,5-6,8-9H2,1-2H3,(H,16,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
YANG JI CHEMICAL CO., LTD.; HAN WHA PHARMA CO., LTD. US Patent					Assay Description Kinases used were human-derived JAK1, JAK2, JAK3, and TYK2 (Millipore, Germany). Each of these kinases was diluted with a suitable buffer solution as...				US Patent US10081635 (2018) BindingDB Entry DOI: 10.7270/Q2R213D4
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568146 (CHEMBL1481541) Show SMILES COc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490894 (CHEMBL2347712) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccccc1OC(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S/c1-2-21-15(24)23-16-22-12-8-7-10(9-14(12)26-16)11-5-3-4-6-13(11)25-17(18,19)20/h3-9H,2H2,1H3,(H2,21,22,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490917 (CHEMBL2347718) Show SMILES CCNC(=O)Nc1nc2ccc(cc2s1)-c1ccc(OC)cc1 Show InChI InChI=1S/C17H17N3O2S/c1-3-18-16(21)20-17-19-14-9-6-12(10-15(14)23-17)11-4-7-13(22-2)8-5-11/h4-10H,3H2,1-2H3,(H2,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM286098 ((R)-3-((7-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)...) Show SMILES CN([C@H]1CN(CC11CC1)S(=O)(=O)c1cccc(c1)C#N)c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C20H20N6O2S/c1-25(19-16-5-8-22-18(16)23-13-24-19)17-11-26(12-20(17)6-7-20)29(27,28)15-4-2-3-14(9-15)10-21/h2-5,8-9,13,17H,6-7,11-12H2,1H3,(H,22,23,24)/t17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.80	n/a	n/a	n/a	n/a	n/a	n/a
YANG JI CHEMICAL CO., LTD.; HAN WHA PHARMA CO., LTD. US Patent					Assay Description Kinases used were human-derived JAK1, JAK2, JAK3, and TYK2 (Millipore, Germany). Each of these kinases was diluted with a suitable buffer solution as...				US Patent US10081635 (2018) BindingDB Entry DOI: 10.7270/Q2R213D4
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490913 (CHEMBL2347709) Show SMILES CCNC(=O)Nc1nc2ccc(cc2o1)-c1ccccc1OC Show InChI InChI=1S/C17H17N3O3/c1-3-18-16(21)20-17-19-13-9-8-11(10-15(13)23-17)12-6-4-5-7-14(12)22-2/h4-10H,3H2,1-2H3,(H2,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490904 (CHEMBL2347739) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccccc1OC Show InChI InChI=1S/C17H18N4O2/c1-3-18-17(22)21-16-19-13-9-8-11(10-14(13)20-16)12-6-4-5-7-15(12)23-2/h4-10H,3H2,1-2H3,(H3,18,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.20	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM286095 ((R)-3-(7-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)a...) Show SMILES CN([C@H]1CN(CC11CC1)C(=O)CC#N)c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C16H18N6O/c1-21(15-11-3-7-18-14(11)19-10-20-15)12-8-22(13(23)2-6-17)9-16(12)4-5-16/h3,7,10,12H,2,4-5,8-9H2,1H3,(H,18,19,20)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.5	n/a	n/a	n/a	n/a	n/a	n/a
YANG JI CHEMICAL CO., LTD.; HAN WHA PHARMA CO., LTD. US Patent					Assay Description Kinases used were human-derived JAK1, JAK2, JAK3, and TYK2 (Millipore, Germany). Each of these kinases was diluted with a suitable buffer solution as...				US Patent US10081635 (2018) BindingDB Entry DOI: 10.7270/Q2R213D4
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490920 (CHEMBL2347747) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1c(OC)cccc1OC Show InChI InChI=1S/C18H20N4O3/c1-4-19-18(23)22-17-20-12-9-8-11(10-13(12)21-17)16-14(24-2)6-5-7-15(16)25-3/h5-10H,4H2,1-3H3,(H3,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490892 (CHEMBL2347715) Show SMILES CCNC(=O)Nc1nc2ccc(nc2s1)-c1ccccc1OC Show InChI InChI=1S/C16H16N4O2S/c1-3-17-15(21)20-16-19-12-9-8-11(18-14(12)23-16)10-6-4-5-7-13(10)22-2/h4-9H,3H2,1-2H3,(H2,17,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490893 (CHEMBL2347714) Show SMILES CCNC(=O)Nc1nc2cc(OC)c(cc2s1)-c1ccccc1OC Show InChI InChI=1S/C18H19N3O3S/c1-4-19-17(22)21-18-20-13-10-15(24-3)12(9-16(13)25-18)11-7-5-6-8-14(11)23-2/h5-10H,4H2,1-3H3,(H2,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490931 (CHEMBL2347736) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccccc1C Show InChI InChI=1S/C17H18N4O/c1-3-18-17(22)21-16-19-14-9-8-12(10-15(14)20-16)13-7-5-4-6-11(13)2/h4-10H,3H2,1-2H3,(H3,18,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568147 (CHEMBL4877433) Show SMILES COc1ccccc1-c1nnc(SCC(=O)Nc2ccc(F)cc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568150 (CHEMBL4857732) Show SMILES COc1cccc(c1)-c1nnc(SCC(=O)Nc2ccccc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490906 (CHEMBL2347737) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccccc1Cl Show InChI InChI=1S/C16H15ClN4O/c1-2-18-16(22)21-15-19-13-8-7-10(9-14(13)20-15)11-5-3-4-6-12(11)17/h3-9H,2H2,1H3,(H3,18,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490901 (CHEMBL2347745) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1c(C)cccc1Cl Show InChI InChI=1S/C17H17ClN4O/c1-3-19-17(23)22-16-20-13-8-7-11(9-14(13)21-16)15-10(2)5-4-6-12(15)18/h4-9H,3H2,1-2H3,(H3,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568149 (CHEMBL4878458) Show SMILES COc1ccccc1-c1nnc(SCC(=O)Nc2ccc(I)cc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490907 (CHEMBL2347753) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1cccs1 Show InChI InChI=1S/C15H14N4O2S/c1-2-16-15(21)19-14-17-10-6-5-9(8-11(10)18-14)13(20)12-4-3-7-22-12/h3-8H,2H2,1H3,(H3,16,17,18,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM286098 ((R)-3-((7-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)...) Show SMILES CN([C@H]1CN(CC11CC1)S(=O)(=O)c1cccc(c1)C#N)c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C20H20N6O2S/c1-25(19-16-5-8-22-18(16)23-13-24-19)17-11-26(12-20(17)6-7-20)29(27,28)15-4-2-3-14(9-15)10-21/h2-5,8-9,13,17H,6-7,11-12H2,1H3,(H,22,23,24)/t17-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	24.7	n/a	n/a	n/a	n/a	n/a	n/a
YANG JI CHEMICAL CO., LTD.; HAN WHA PHARMA CO., LTD. US Patent					Assay Description Kinases used were human-derived JAK1, JAK2, JAK3, and TYK2 (Millipore, Germany). Each of these kinases was diluted with a suitable buffer solution as...				US Patent US10081635 (2018) BindingDB Entry DOI: 10.7270/Q2R213D4
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568151 (CHEMBL4849416) Show SMILES COc1cccc(c1)-c1nnc(SCC(=O)Nc2ccc(F)cc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM286096 (3-(7-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino...) Show SMILES CN(C1CN(CC11CC1)C(=O)CC#N)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C16H18N6O/c1-21(15-11-3-7-18-14(11)19-10-20-15)12-8-22(13(23)2-6-17)9-16(12)4-5-16/h3,7,10,12H,2,4-5,8-9H2,1H3,(H,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	29.3	n/a	n/a	n/a	n/a	n/a	n/a
YANG JI CHEMICAL CO., LTD.; HAN WHA PHARMA CO., LTD. US Patent					Assay Description Kinases used were human-derived JAK1, JAK2, JAK3, and TYK2 (Millipore, Germany). Each of these kinases was diluted with a suitable buffer solution as...				US Patent US10081635 (2018) BindingDB Entry DOI: 10.7270/Q2R213D4
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568144 (CHEMBL4867234) Show SMILES Brc1ccc(NC(=O)CSc2nnc(o2)-c2ccccc2)cc1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490899 (CHEMBL2347749) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C16H17N5O/c1-3-17-16(22)21-15-19-13-5-4-11(9-14(13)20-15)12-6-7-18-10(2)8-12/h4-9H,3H2,1-2H3,(H3,17,19,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM286096 (3-(7-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino...) Show SMILES CN(C1CN(CC11CC1)C(=O)CC#N)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C16H18N6O/c1-21(15-11-3-7-18-14(11)19-10-20-15)12-8-22(13(23)2-6-17)9-16(12)4-5-16/h3,7,10,12H,2,4-5,8-9H2,1H3,(H,18,19,20)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40.4	n/a	n/a	n/a	n/a	n/a	n/a
YANG JI CHEMICAL CO., LTD.; HAN WHA PHARMA CO., LTD. US Patent					Assay Description Kinases used were human-derived JAK1, JAK2, JAK3, and TYK2 (Millipore, Germany). Each of these kinases was diluted with a suitable buffer solution as...				US Patent US10081635 (2018) BindingDB Entry DOI: 10.7270/Q2R213D4
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490900 (CHEMBL2347746) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1c(Cl)cccc1Cl Show InChI InChI=1S/C16H14Cl2N4O/c1-2-19-16(23)22-15-20-12-7-6-9(8-13(12)21-15)14-10(17)4-3-5-11(14)18/h3-8H,2H2,1H3,(H3,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490924 (CHEMBL472525) Show SMILES CCNC(=O)Nc1nc2cc(ccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C16H16N4O/c1-2-17-16(21)20-15-18-13-9-8-12(10-14(13)19-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H3,17,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490922 (CHEMBL2347738) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1ccccc1CC Show InChI InChI=1S/C18H20N4O/c1-3-12-7-5-6-8-14(12)13-9-10-15-16(11-13)21-17(20-15)22-18(23)19-4-2/h5-11H,3-4H2,1-2H3,(H3,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50490914 (CHEMBL2347744) Show SMILES CCNC(=O)Nc1nc2ccc(cc2[nH]1)-c1c(C)cccc1C Show InChI InChI=1S/C18H20N4O/c1-4-19-18(23)22-17-20-14-9-8-13(10-15(14)21-17)16-11(2)6-5-7-12(16)3/h5-10H,4H2,1-3H3,(H3,19,20,21,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of breakpoint cluster region-Abelson tyrosine kinase T315I mutant (unknown origin) using [gamma-33P]ATP as substrate by radiometric kinase...				J Med Chem 56: 3531-45 (2013) Article DOI: 10.1021/jm301891t BindingDB Entry DOI: 10.7270/Q2BG2RW2
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50568148 (CHEMBL4859278) Show SMILES COc1ccccc1-c1nnc(SCC(=O)Nc2ccc(Br)cc2)o1 Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mushroom tyrosinase using L-DOPA as substrate				Citation and Details Article DOI: 10.1016/j.bmc.2021.116222 BindingDB Entry DOI: 10.7270/Q24171T1
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 87 total )  |  Next  |  Last  >>

Jump to: