Compile Data Set for Download or QSAR

Found 101 hits with Last Name = 'park' and Initial = 'jw'   

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
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237840 (CHEMBL256558 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Cc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C19H20N4O3S/c1-13-3-5-14(6-4-13)11-18(24)20-19-16-12-15(7-8-17(16)21-22-19)23-9-2-10-27(23,25)26/h3-8,12H,2,9-11H2,1H3,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237863 (2-(3-bromo-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-isot...) Show SMILES Brc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C18H17BrN4O3S/c19-13-4-1-3-12(9-13)10-17(24)20-18-15-11-14(5-6-16(15)21-22-18)23-7-2-8-27(23,25)26/h1,3-6,9,11H,2,7-8,10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237848 (2-(4-bromo-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-isot...) Show SMILES Brc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H17BrN4O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50085415 (3-(3,5-Dibromo-4-hydroxy-benzylidene)-5-iodo-1,3-d...) Show SMILES Oc1c(Br)cc(\C=C2/C(=O)Nc3ccc(I)cc23)cc1Br Show InChI InChI=1S/C15H8Br2INO2/c16-11-4-7(5-12(17)14(11)20)3-10-9-6-8(18)1-2-13(9)19-15(10)21/h1-6,20H,(H,19,21)/b10-3-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	7.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human CRAF using MEK1 (K97R) as substrate in presence of [gamma-33P]ATP by scintillation counting method				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112756 BindingDB Entry DOI: 10.7270/Q2BP06GC
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM50085415 (3-(3,5-Dibromo-4-hydroxy-benzylidene)-5-iodo-1,3-d...) Show SMILES Oc1c(Br)cc(\C=C2/C(=O)Nc3ccc(I)cc23)cc1Br Show InChI InChI=1S/C15H8Br2INO2/c16-11-4-7(5-12(17)14(11)20)3-10-9-6-8(18)1-2-13(9)19-15(10)21/h1-6,20H,(H,19,21)/b10-3-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	7.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human BRAF V600E mutant using MEK1 (K97R) as substrate in presence of [gamma-33P]ATP by scintillation counting method				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112756 BindingDB Entry DOI: 10.7270/Q2BP06GC
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237857 (CHEMBL254979 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1ccc2ccccc2c1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C22H20N4O3S/c27-21(13-15-6-7-16-4-1-2-5-17(16)12-15)23-22-19-14-18(8-9-20(19)24-25-22)26-10-3-11-30(26,28)29/h1-2,4-9,12,14H,3,10-11,13H2,(H2,23,24,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237854 (CHEMBL255718 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Oc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H18N4O4S/c23-14-5-2-12(3-6-14)10-17(24)19-18-15-11-13(4-7-16(15)20-21-18)22-8-1-9-27(22,25)26/h2-7,11,23H,1,8-10H2,(H2,19,20,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237853 (2-(4-dimethylamino-phenyl)-N-[5-(1,1-dioxo-1lambda...) Show SMILES CN(C)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C20H23N5O3S/c1-24(2)15-6-4-14(5-7-15)12-19(26)21-20-17-13-16(8-9-18(17)22-23-20)25-10-3-11-29(25,27)28/h4-9,13H,3,10-12H2,1-2H3,(H2,21,22,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237865 (CHEMBL255262 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Fc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C18H17FN4O3S/c19-13-4-1-3-12(9-13)10-17(24)20-18-15-11-14(5-6-16(15)21-22-18)23-7-2-8-27(23,25)26/h1,3-6,9,11H,2,7-8,10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237846 (CHEMBL415789 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES CSc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C19H20N4O3S2/c1-27-15-6-3-13(4-7-15)11-18(24)20-19-16-12-14(5-8-17(16)21-22-19)23-9-2-10-28(23,25)26/h3-8,12H,2,9-11H2,1H3,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237850 (CHEMBL403605 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Cc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C19H20N4O3S/c1-13-4-2-5-14(10-13)11-18(24)20-19-16-12-15(6-7-17(16)21-22-19)23-8-3-9-27(23,25)26/h2,4-7,10,12H,3,8-9,11H2,1H3,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237841 (2-(4-chloro-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-iso...) Show SMILES Clc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H17ClN4O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237861 (2-(3-chloro-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-iso...) Show SMILES Clc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C18H17ClN4O3S/c19-13-4-1-3-12(9-13)10-17(24)20-18-15-11-14(5-6-16(15)21-22-18)23-7-2-8-27(23,25)26/h1,3-6,9,11H,2,7-8,10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237841 (2-(4-chloro-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-iso...) Show SMILES Clc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H17ClN4O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM50085415 (3-(3,5-Dibromo-4-hydroxy-benzylidene)-5-iodo-1,3-d...) Show SMILES Oc1c(Br)cc(\C=C2/C(=O)Nc3ccc(I)cc23)cc1Br Show InChI InChI=1S/C15H8Br2INO2/c16-11-4-7(5-12(17)14(11)20)3-10-9-6-8(18)1-2-13(9)19-15(10)21/h1-6,20H,(H,19,21)/b10-3-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human BRAF using MEK1 (K97R) as substrate in presence of [gamma-33P]ATP by scintillation counting method				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112756 BindingDB Entry DOI: 10.7270/Q2BP06GC
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237851 (2-biphenyl-4-yl-N-[5-(1,1-dioxo-1lambda*6*-isothia...) Show SMILES O=C(Cc1ccc(cc1)-c1ccccc1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C24H22N4O3S/c29-23(15-17-7-9-19(10-8-17)18-5-2-1-3-6-18)25-24-21-16-20(11-12-22(21)26-27-24)28-13-4-14-32(28,30)31/h1-3,5-12,16H,4,13-15H2,(H2,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237860 (2-(4-amino-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-isot...) Show SMILES Nc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H19N5O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10,19H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237855 (CHEMBL255263 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Fc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H17FN4O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237844 (CHEMBL254367 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1cccc2ccccc12)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C22H20N4O3S/c27-21(13-16-7-3-6-15-5-1-2-8-18(15)16)23-22-19-14-17(9-10-20(19)24-25-22)26-11-4-12-30(26,28)29/h1-3,5-10,14H,4,11-13H2,(H2,23,24,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237847 (CHEMBL254170 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES CS(=O)(=O)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C19H20N4O5S2/c1-29(25,26)15-6-3-13(4-7-15)11-18(24)20-19-16-12-14(5-8-17(16)21-22-19)23-9-2-10-30(23,27)28/h3-8,12H,2,9-11H2,1H3,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237848 (2-(4-bromo-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-isot...) Show SMILES Brc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H17BrN4O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237858 (2-(2-chloro-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-iso...) Show SMILES Clc1ccccc1CC(=O)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C18H17ClN4O3S/c19-15-5-2-1-4-12(15)10-17(24)20-18-14-11-13(6-7-16(14)21-22-18)23-8-3-9-27(23,25)26/h1-2,4-7,11H,3,8-10H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237854 (CHEMBL255718 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Oc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H18N4O4S/c23-14-5-2-12(3-6-14)10-17(24)19-18-15-11-13(4-7-16(15)20-21-18)22-8-1-9-27(22,25)26/h2-7,11,23H,1,8-10H2,(H2,19,20,21,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237853 (2-(4-dimethylamino-phenyl)-N-[5-(1,1-dioxo-1lambda...) Show SMILES CN(C)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C20H23N5O3S/c1-24(2)15-6-4-14(5-7-15)12-19(26)21-20-17-13-16(8-9-18(17)22-23-20)25-10-3-11-29(25,27)28/h4-9,13H,3,10-12H2,1-2H3,(H2,21,22,23,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237865 (CHEMBL255262 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Fc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C18H17FN4O3S/c19-13-4-1-3-12(9-13)10-17(24)20-18-15-11-14(5-6-16(15)21-22-18)23-7-2-8-27(23,25)26/h1,3-6,9,11H,2,7-8,10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237856 (CHEMBL254171 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1ccc(cc1)-c1ccncc1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C23H21N5O3S/c29-22(14-16-2-4-17(5-3-16)18-8-10-24-11-9-18)25-23-20-15-19(6-7-21(20)26-27-23)28-12-1-13-32(28,30)31/h2-11,15H,1,12-14H2,(H2,25,26,27,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237845 (CHEMBL258040 | N-[5-(1,1-DIOXIDOISOTHIAZOLIDIN-2-Y...) Show SMILES O=C(Cc1ccc(cc1)N1CCCCC1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C23H27N5O3S/c29-22(15-17-5-7-18(8-6-17)27-11-2-1-3-12-27)24-23-20-16-19(9-10-21(20)25-26-23)28-13-4-14-32(28,30)31/h5-10,16H,1-4,11-15H2,(H2,24,25,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237861 (2-(3-chloro-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-iso...) Show SMILES Clc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C18H17ClN4O3S/c19-13-4-1-3-12(9-13)10-17(24)20-18-15-11-14(5-6-16(15)21-22-18)23-7-2-8-27(23,25)26/h1,3-6,9,11H,2,7-8,10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237843 (CHEMBL255255 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1ccccc1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C18H18N4O3S/c23-17(11-13-5-2-1-3-6-13)19-18-15-12-14(7-8-16(15)20-21-18)22-9-4-10-26(22,24)25/h1-3,5-8,12H,4,9-11H2,(H2,19,20,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237840 (CHEMBL256558 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Cc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C19H20N4O3S/c1-13-3-5-14(6-4-13)11-18(24)20-19-16-12-15(7-8-17(16)21-22-19)23-9-2-10-27(23,25)26/h3-8,12H,2,9-11H2,1H3,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237842 (2-(4-diethylamino-phenyl)-N-[5-(1,1-dioxo-1lambda*...) Show SMILES CCN(CC)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C22H27N5O3S/c1-3-26(4-2)17-8-6-16(7-9-17)14-21(28)23-22-19-15-18(10-11-20(19)24-25-22)27-12-5-13-31(27,29)30/h6-11,15H,3-5,12-14H2,1-2H3,(H2,23,24,25,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237857 (CHEMBL254979 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1ccc2ccccc2c1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C22H20N4O3S/c27-21(13-15-6-7-16-4-1-2-5-17(16)12-15)23-22-19-14-18(8-9-20(19)24-25-22)26-10-3-11-30(26,28)29/h1-2,4-9,12,14H,3,10-11,13H2,(H2,23,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237846 (CHEMBL415789 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES CSc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C19H20N4O3S2/c1-27-15-6-3-13(4-7-15)11-18(24)20-19-16-12-14(5-8-17(16)21-22-19)23-9-2-10-28(23,25)26/h3-8,12H,2,9-11H2,1H3,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237851 (2-biphenyl-4-yl-N-[5-(1,1-dioxo-1lambda*6*-isothia...) Show SMILES O=C(Cc1ccc(cc1)-c1ccccc1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C24H22N4O3S/c29-23(15-17-7-9-19(10-8-17)18-5-2-1-3-6-18)25-24-21-16-20(11-12-22(21)26-27-24)28-13-4-14-32(28,30)31/h1-3,5-12,16H,4,13-15H2,(H2,25,26,27,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237863 (2-(3-bromo-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-isot...) Show SMILES Brc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C18H17BrN4O3S/c19-13-4-1-3-12(9-13)10-17(24)20-18-15-11-14(5-6-16(15)21-22-18)23-7-2-8-27(23,25)26/h1,3-6,9,11H,2,7-8,10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237855 (CHEMBL255263 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Fc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H17FN4O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237850 (CHEMBL403605 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES Cc1cccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)c1 Show InChI InChI=1S/C19H20N4O3S/c1-13-4-2-5-14(10-13)11-18(24)20-19-16-12-15(6-7-17(16)21-22-19)23-8-3-9-27(23,25)26/h2,4-7,10,12H,3,8-9,11H2,1H3,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237842 (2-(4-diethylamino-phenyl)-N-[5-(1,1-dioxo-1lambda*...) Show SMILES CCN(CC)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C22H27N5O3S/c1-3-26(4-2)17-8-6-16(7-9-17)14-21(28)23-22-19-15-18(10-11-20(19)24-25-22)27-12-5-13-31(27,29)30/h6-11,15H,3-5,12-14H2,1-2H3,(H2,23,24,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237856 (CHEMBL254171 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1ccc(cc1)-c1ccncc1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C23H21N5O3S/c29-22(14-16-2-4-17(5-3-16)18-8-10-24-11-9-18)25-23-20-15-19(6-7-21(20)26-27-23)28-12-1-13-32(28,30)31/h2-11,15H,1,12-14H2,(H2,25,26,27,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237860 (2-(4-amino-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-isot...) Show SMILES Nc1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C18H19N5O3S/c19-13-4-2-12(3-5-13)10-17(24)20-18-15-11-14(6-7-16(15)21-22-18)23-8-1-9-27(23,25)26/h2-7,11H,1,8-10,19H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237844 (CHEMBL254367 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1cccc2ccccc12)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C22H20N4O3S/c27-21(13-16-7-3-6-15-5-1-2-8-18(15)16)23-22-19-14-17(9-10-20(19)24-25-22)26-11-4-12-30(26,28)29/h1-3,5-10,14H,4,11-13H2,(H2,23,24,25,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237858 (2-(2-chloro-phenyl)-N-[5-(1,1-dioxo-1lambda*6*-iso...) Show SMILES Clc1ccccc1CC(=O)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C18H17ClN4O3S/c19-15-5-2-1-4-12(15)10-17(24)20-18-14-11-13(6-7-16(14)21-22-18)23-8-3-9-27(23,25)26/h1-2,4-7,11H,3,8-10H2,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank 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
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237843 (CHEMBL255255 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES O=C(Cc1ccccc1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C18H18N4O3S/c23-17(11-13-5-2-1-3-6-13)19-18-15-12-14(7-8-16(15)20-21-18)22-9-4-10-26(22,24)25/h1-3,5-8,12H,4,9-11H2,(H2,19,20,21,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237845 (CHEMBL258040 | N-[5-(1,1-DIOXIDOISOTHIAZOLIDIN-2-Y...) Show SMILES O=C(Cc1ccc(cc1)N1CCCCC1)Nc1n[nH]c2ccc(cc12)N1CCCS1(=O)=O Show InChI InChI=1S/C23H27N5O3S/c29-22(15-17-5-7-18(8-6-17)27-11-2-1-3-12-27)24-23-20-16-19(9-10-21(20)25-26-23)28-13-4-14-32(28,30)31/h5-10,16H,1-4,11-15H2,(H2,24,25,26,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237864 (CHEMBL404747 | N-(5-(2-oxopyrrolidin-1-yl)-1H-inda...) Show SMILES O=C(Cc1ccccc1)Nc1n[nH]c2ccc(cc12)N1CCCC1=O Show InChI InChI=1S/C19H18N4O2/c24-17(11-13-5-2-1-3-6-13)20-19-15-12-14(8-9-16(15)21-22-19)23-10-4-7-18(23)25/h1-3,5-6,8-9,12H,4,7,10-11H2,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50237862 (CHEMBL402910 | N-(5-(diethylamino)-1H-indazol-3-yl...) Show SMILES CCN(CC)c1ccc2[nH]nc(NC(=O)Cc3ccccc3)c2c1 Show InChI InChI=1S/C19H22N4O/c1-3-23(4-2)15-10-11-17-16(13-15)19(22-21-17)20-18(24)12-14-8-6-5-7-9-14/h5-11,13H,3-4,12H2,1-2H3,(H2,20,21,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK2				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50237847 (CHEMBL254170 | N-[5-(1,1-dioxo-1lambda*6*-isothiaz...) Show SMILES CS(=O)(=O)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C19H20N4O5S2/c1-29(25,26)15-6-3-13(4-7-15)11-18(24)20-19-16-12-14(5-8-17(16)21-22-19)23-9-2-10-30(23,27)28/h3-8,12H,2,9-11H2,1H3,(H2,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK1				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 4 (Homo sapiens (Human))	BDBM50237853 (2-(4-dimethylamino-phenyl)-N-[5-(1,1-dioxo-1lambda...) Show SMILES CN(C)c1ccc(CC(=O)Nc2n[nH]c3ccc(cc23)N2CCCS2(=O)=O)cc1 Show InChI InChI=1S/C20H23N5O3S/c1-24(2)15-6-4-14(5-7-15)12-19(26)21-20-17-13-16(8-9-18(17)22-23-20)25-10-3-11-29(25,27)28/h4-9,13H,3,10-12H2,1-2H3,(H2,21,22,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Keimyung University Curated by ChEMBL					Assay Description Inhibition of CDK4				Bioorg Med Chem Lett 18: 2292-5 (2008) Article DOI: 10.1016/j.bmcl.2008.03.002 BindingDB Entry DOI: 10.7270/Q2QN66H5
					More data for this Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50556317 (CHEMBL4795732) Show SMILES CCN1CCN(CC1)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(Nc2ccc3c(OC)cccc3n2)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	229	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human CRAF using MEK1 (K97R) as substrate in presence of [gamma-33P]ATP by scintillation counting method				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112756 BindingDB Entry DOI: 10.7270/Q2BP06GC
					More data for this Ligand-Target Pair
Heat shock protein HSP 90-beta (Homo sapiens (Human))	BDBM20732 ((4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14,...) Show SMILES CO[C@H]1CC(C)=Cc2c(O)c(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2OC |r,w:16.16,6.6,t:28| Show InChI InChI=1S/C29H40N2O9/c1-15-11-19-25(34)20(14-21(32)27(19)39-7)31-28(35)16(2)9-8-10-22(37-5)26(40-29(30)36)18(4)13-17(3)24(33)23(12-15)38-6/h8-11,13-14,17,22-24,26,32-34H,12H2,1-7H3,(H2,30,36)(H,31,35)/b10-8?,15-11?,16-9?,18-13+/t17-,22-,23-,24+,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	348	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Inhibition of HSP90 using VER-00045864 probe by fluorescence polarization assay				J Med Chem 55: 10863-84 (2012) Article DOI: 10.1021/jm301488q BindingDB Entry DOI: 10.7270/Q2K075FF
					More data for this Ligand-Target Pair				3D Structure (crystal)

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