Compile Data Set for Download or QSAR

Found 76 hits with Last Name = 'shiffman' and Initial = 'd'   

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/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50113739 (2(bis-(hydroxyethyl)amino)-6-(4-methoxybenzylamino...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(CCO)CCO)cc1 Show InChI InChI=1S/C20H28N6O3/c1-14(2)26-13-22-17-18(21-12-15-4-6-16(29-3)7-5-15)23-20(24-19(17)26)25(8-10-27)9-11-28/h4-7,13-14,27-28H,8-12H2,1-3H3,(H,21,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290586 (2-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...) Show SMILES COc1ccc(CNc2nc(NC(C)(O)CO)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C19H26N6O3/c1-12(2)25-11-21-15-16(20-9-13-5-7-14(28-4)8-6-13)22-18(23-17(15)25)24-19(3,27)10-26/h5-8,11-12,26-27H,9-10H2,1-4H3,(H2,20,22,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290560 (2-[[6-(Biphenyl-4-ylamino)-9-isopropyl-9H-purin-2-...) Show SMILES CC(C)n1cnc2c(Nc3ccc(cc3)-c3ccccc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C24H28N6O2/c1-17(2)30-16-25-21-22(27-24(28-23(21)30)29(12-14-31)13-15-32)26-20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,16-17,31-32H,12-15H2,1-2H3,(H,26,27,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290593 (3-{6-[(Biphenyl-4-ylmethyl)-amino]-9-isopropyl-9H-...) Show SMILES CC(C)n1cnc2c(NCc3ccc(cc3)-c3ccccc3)nc(NCC(O)CO)nc12 Show InChI InChI=1S/C24H28N6O2/c1-16(2)30-15-27-21-22(28-24(29-23(21)30)26-13-20(32)14-31)25-12-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,15-16,20,31-32H,12-14H2,1-2H3,(H2,25,26,28,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290609 (2-{(2-Hydroxy-ethyl)-[9-isopropyl-6-(4-thiophen-2-...) Show SMILES CC(C)n1cnc2c(NCc3ccc(cc3)-c3cccs3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C23H28N6O2S/c1-16(2)29-15-25-20-21(26-23(27-22(20)29)28(9-11-30)10-12-31)24-14-17-5-7-18(8-6-17)19-4-3-13-32-19/h3-8,13,15-16,30-31H,9-12,14H2,1-2H3,(H,24,26,27)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290623 (2-[{6-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-9-isop...) Show SMILES CC(C)n1cnc2c(NCc3ccc4OCOc4c3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C20H26N6O4/c1-13(2)26-11-22-17-18(21-10-14-3-4-15-16(9-14)30-12-29-15)23-20(24-19(17)26)25(5-7-27)6-8-28/h3-4,9,11,13,27-28H,5-8,10,12H2,1-2H3,(H,21,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290600 (2-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...) Show SMILES COc1ccc(CNc2nc(NC3CCCCC3O)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C22H30N6O2/c1-14(2)28-13-24-19-20(23-12-15-8-10-16(30-3)11-9-15)26-22(27-21(19)28)25-17-6-4-5-7-18(17)29/h8-11,13-14,17-18,29H,4-7,12H2,1-3H3,(H2,23,25,26,27)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290613 (2-[2-[Bis-(2-hydroxy-ethyl)-amino]-6-(4-methoxy-be...) Show SMILES COc1ccc(CNc2nc(nc3n(CCO)cnc23)N(CCO)CCO)cc1 Show InChI InChI=1S/C19H26N6O4/c1-29-15-4-2-14(3-5-15)12-20-17-16-18(25(8-11-28)13-21-16)23-19(22-17)24(6-9-26)7-10-27/h2-5,13,26-28H,6-12H2,1H3,(H,20,22,23)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290611 (2-[{6-[(Biphenyl-4-ylmethyl)-amino]-9-isopropyl-9H...) Show SMILES CC(C)n1cnc2c(NCc3ccc(cc3)-c3ccccc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C25H30N6O2/c1-18(2)31-17-27-22-23(28-25(29-24(22)31)30(12-14-32)13-15-33)26-16-19-8-10-21(11-9-19)20-6-4-3-5-7-20/h3-11,17-18,32-33H,12-16H2,1-2H3,(H,26,28,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290602 (3-{[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(CC(C)C#N)Cc2cccnc2)cc1 Show InChI InChI=1S/C26H30N8O/c1-18(2)34-17-30-23-24(29-14-20-7-9-22(35-4)10-8-20)31-26(32-25(23)34)33(15-19(3)12-27)16-21-6-5-11-28-13-21/h5-11,13,17-19H,14-16H2,1-4H3,(H,29,31,32)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290581 (2-[[6-(4-Bromo-phenylamino)-9-isopropyl-9H-purin-2...) Show SMILES CC(C)n1cnc2c(Nc3ccc(Br)cc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C18H23BrN6O2/c1-12(2)25-11-20-15-16(21-14-5-3-13(19)4-6-14)22-18(23-17(15)25)24(7-9-26)8-10-27/h3-6,11-12,26-27H,7-10H2,1-2H3,(H,21,22,23)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50113740 (2-{Benzyl-[9-isopropyl-6-(4-methoxy-benzylamino)-9...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(CCO)Cc2ccccc2)cc1 Show InChI InChI=1S/C25H30N6O2/c1-18(2)31-17-27-22-23(26-15-19-9-11-21(33-3)12-10-19)28-25(29-24(22)31)30(13-14-32)16-20-7-5-4-6-8-20/h4-12,17-18,32H,13-16H2,1-3H3,(H,26,28,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290599 ((4-Chloro-benzyl)-(2-chloro-9-trifluoromethyl-9H-p...) Show SMILES FC(F)(F)n1cnc2c(NCc3ccc(Cl)cc3)nc(Cl)nc12 Show InChI InChI=1S/C13H8Cl2F3N5/c14-8-3-1-7(2-4-8)5-19-10-9-11(22-12(15)21-10)23(6-20-9)13(16,17)18/h1-4,6H,5H2,(H,19,21,22)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290596 (2-Amino-1-[9-isopropyl-6-(4-methoxy-benzylamino)-9...) Show SMILES COc1ccc(CNc2nc(NC(O)CN)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C18H25N7O2/c1-11(2)25-10-21-15-16(20-9-12-4-6-13(27-3)7-5-12)23-18(24-17(15)25)22-14(26)8-19/h4-7,10-11,14,26H,8-9,19H2,1-3H3,(H2,20,22,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50113727 (2-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...) Show SMILES COc1ccc(CNc2nc(NCCO)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C18H24N6O2/c1-12(2)24-11-21-15-16(22-18(19-8-9-25)23-17(15)24)20-10-13-4-6-14(26-3)7-5-13/h4-7,11-12,25H,8-10H2,1-3H3,(H2,19,20,22,23)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290622 (CHEMBL90860 | N*2*-[2-(1H-Indol-3-yl)-ethyl]-9-iso...) Show SMILES COc1ccc(CNc2nc(NCCc3c[nH]c4ccccc34)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C26H29N7O/c1-17(2)33-16-30-23-24(29-14-18-8-10-20(34-3)11-9-18)31-26(32-25(23)33)27-13-12-19-15-28-22-7-5-4-6-21(19)22/h4-11,15-17,28H,12-14H2,1-3H3,(H2,27,29,31,32)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290573 (2-{(2-Hydroxy-ethyl)-[9-isopropyl-6-(quinolin-3-yl...) Show SMILES CC(C)n1cnc2c(Nc3cnc4ccccc4c3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C21H25N7O2/c1-14(2)28-13-23-18-19(24-16-11-15-5-3-4-6-17(15)22-12-16)25-21(26-20(18)28)27(7-9-29)8-10-30/h3-6,11-14,29-30H,7-10H2,1-2H3,(H,24,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290589 (2-{(2-Hydroxy-ethyl)-[6-(4-methoxy-benzylamino)-9-...) Show SMILES CCC(C)Cn1cnc2c(NCc3ccc(OC)cc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C22H32N6O3/c1-4-16(2)14-28-15-24-19-20(23-13-17-5-7-18(31-3)8-6-17)25-22(26-21(19)28)27(9-11-29)10-12-30/h5-8,15-16,29-30H,4,9-14H2,1-3H3,(H,23,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290614 (2-{(2-Hydroxy-ethyl)-[6-(4-methoxy-benzylamino)-9-...) Show SMILES COc1ccc(CNc2nc(nc3n(Cc4cccc(c4)[N+]([O-])=O)cnc23)N(CCO)CCO)cc1 Show InChI InChI=1S/C24H27N7O5/c1-36-20-7-5-17(6-8-20)14-25-22-21-23(28-24(27-22)29(9-11-32)10-12-33)30(16-26-21)15-18-3-2-4-19(13-18)31(34)35/h2-8,13,16,32-33H,9-12,14-15H2,1H3,(H,25,27,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290610 (2-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...) Show SMILES COc1ccc(CNc2nc(NC(CO)Cc3ccccc3)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C25H30N6O2/c1-17(2)31-16-27-22-23(26-14-19-9-11-21(33-3)12-10-19)29-25(30-24(22)31)28-20(15-32)13-18-7-5-4-6-8-18/h4-12,16-17,20,32H,13-15H2,1-3H3,(H2,26,28,29,30)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290567 (2-[[6-(Cyclopropyl-methyl-amino)-9-isopropyl-9H-pu...) Show SMILES CC(C)n1cnc2c(nc(nc12)N(CCO)CCO)N(C)C1CC1 Show InChI InChI=1S/C16H26N6O2/c1-11(2)22-10-17-13-14(20(3)12-4-5-12)18-16(19-15(13)22)21(6-8-23)7-9-24/h10-12,23-24H,4-9H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290579 (2-[(2-Hydroxy-ethyl)-(9-isopropyl-6-phenylamino-9H...) Show SMILES CC(C)n1cnc2c(Nc3ccccc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C18H24N6O2/c1-13(2)24-12-19-15-16(20-14-6-4-3-5-7-14)21-18(22-17(15)24)23(8-10-25)9-11-26/h3-7,12-13,25-26H,8-11H2,1-2H3,(H,20,21,22)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290566 (2-[[6-(4-Butyl-benzylamino)-9-isopropyl-9H-purin-2...) Show SMILES CCCCc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(CCO)CCO)cc1 Show InChI InChI=1S/C23H34N6O2/c1-4-5-6-18-7-9-19(10-8-18)15-24-21-20-22(29(16-25-20)17(2)3)27-23(26-21)28(11-13-30)12-14-31/h7-10,16-17,30-31H,4-6,11-15H2,1-3H3,(H,24,26,27)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50113694 (3-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...) Show SMILES COc1ccc(CNc2nc(NCC(O)CO)nc3n(cnc23)C(C)C)cc1 Show InChI InChI=1S/C19H26N6O3/c1-12(2)25-11-22-16-17(20-8-13-4-6-15(28-3)7-5-13)23-19(24-18(16)25)21-9-14(27)10-26/h4-7,11-12,14,26-27H,8-10H2,1-3H3,(H2,20,21,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290618 (2-[[9-Cyclopentyl-6-(4-methoxy-benzylamino)-9H-pur...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C2CCCC2)N(CCO)CCO)cc1 Show InChI InChI=1S/C22H30N6O3/c1-31-18-8-6-16(7-9-18)14-23-20-19-21(28(15-24-19)17-4-2-3-5-17)26-22(25-20)27(10-12-29)11-13-30/h6-9,15,17,29-30H,2-5,10-14H2,1H3,(H,23,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290563 (2-[[6-(4-Bromo-benzylamino)-9-isopropyl-9H-purin-2...) Show SMILES CC(C)n1cnc2c(NCc3ccc(Br)cc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C19H25BrN6O2/c1-13(2)26-12-22-16-17(21-11-14-3-5-15(20)6-4-14)23-19(24-18(16)26)25(7-9-27)8-10-28/h3-6,12-13,27-28H,7-11H2,1-2H3,(H,21,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290603 (2-{(2-Hydroxy-ethyl)-[9-isobutyl-6-(4-methoxy-benz...) Show SMILES COc1ccc(CNc2nc(nc3n(CC(C)C)cnc23)N(CCO)CCO)cc1 Show InChI InChI=1S/C21H30N6O3/c1-15(2)13-27-14-23-18-19(22-12-16-4-6-17(30-3)7-5-16)24-21(25-20(18)27)26(8-10-28)9-11-29/h4-7,14-15,28-29H,8-13H2,1-3H3,(H,22,24,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50113723 (1-[9-Isopropyl-6-(4-methoxy-benzylamino)-9H-purin-...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N2CCC(O)CC2)cc1 Show InChI InChI=1S/C21H28N6O2/c1-14(2)27-13-23-18-19(22-12-15-4-6-17(29-3)7-5-15)24-21(25-20(18)27)26-10-8-16(28)9-11-26/h4-7,13-14,16,28H,8-12H2,1-3H3,(H,22,24,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290594 (2-{(2-Hydroxy-ethyl)-[6-(4-methoxy-benzylamino)-9-...) Show SMILES COc1ccc(CNc2nc(nc3n(Cc4ccc(cc4)[N+]([O-])=O)cnc23)N(CCO)CCO)cc1 Show InChI InChI=1S/C24H27N7O5/c1-36-20-8-4-17(5-9-20)14-25-22-21-23(28-24(27-22)29(10-12-32)11-13-33)30(16-26-21)15-18-2-6-19(7-3-18)31(34)35/h2-9,16,32-33H,10-15H2,1H3,(H,25,27,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290590 (2-[6-(4-Methoxy-benzylamino)-9-methyl-9H-purin-2-y...) Show SMILES COc1ccc(CNc2nc(NCCO)nc3n(C)cnc23)cc1 Show InChI InChI=1S/C16H20N6O2/c1-22-10-19-13-14(20-16(17-7-8-23)21-15(13)22)18-9-11-3-5-12(24-2)6-4-11/h3-6,10,23H,7-9H2,1-2H3,(H2,17,18,20,21)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290607 (4-(1-Hydroxy-2-{[9-isopropyl-6-(4-methoxy-benzylam...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(C)CC(O)c2ccc(O)c(O)c2)cc1 Show InChI InChI=1S/C25H30N6O4/c1-15(2)31-14-27-22-23(26-12-16-5-8-18(35-4)9-6-16)28-25(29-24(22)31)30(3)13-21(34)17-7-10-19(32)20(33)11-17/h5-11,14-15,21,32-34H,12-13H2,1-4H3,(H,26,28,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290564 (1-{6-[(Biphenyl-4-ylmethyl)-amino]-9-isopropyl-9H-...) Show SMILES CC(O)Nc1nc(NCc2ccc(cc2)-c2ccccc2)c2ncn(C(C)C)c2n1 Show InChI InChI=1S/C23H26N6O/c1-15(2)29-14-25-20-21(27-23(26-16(3)30)28-22(20)29)24-13-17-9-11-19(12-10-17)18-7-5-4-6-8-18/h4-12,14-16,30H,13H2,1-3H3,(H2,24,26,27,28)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290561 (2-{(2-Hydroxy-ethyl)-[6-(4-methoxy-benzylamino)-9-...) Show SMILES CCCCCCCC\C=C/CCCCCCCCn1cnc2c(NCc3ccc(OC)cc3)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C35H56N6O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-41-29-37-32-33(36-28-30-19-21-31(44-2)22-20-30)38-35(39-34(32)41)40(24-26-42)25-27-43/h10-11,19-22,29,42-43H,3-9,12-18,23-28H2,1-2H3,(H,36,38,39)/b11-10-	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290571 ((2-Chloro-9-methyl-9H-purin-6-yl)-(4-methoxy-benzy...) Show SMILES COc1ccc(CNc2nc(Cl)nc3n(C)cnc23)cc1 Show InChI InChI=1S/C14H14ClN5O/c1-20-8-17-11-12(18-14(15)19-13(11)20)16-7-9-3-5-10(21-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,16,18,19)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290571 ((2-Chloro-9-methyl-9H-purin-6-yl)-(4-methoxy-benzy...) Show SMILES COc1ccc(CNc2nc(Cl)nc3n(C)cnc23)cc1 Show InChI InChI=1S/C14H14ClN5O/c1-20-8-17-11-12(18-14(15)19-13(11)20)16-7-9-3-5-10(21-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,16,18,19)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290608 (CHEMBL91378 | {1-[9-Isopropyl-6-(4-methoxy-benzyla...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N2CCCCC2CO)cc1 Show InChI InChI=1S/C22H30N6O2/c1-15(2)28-14-24-19-20(23-12-16-7-9-18(30-3)10-8-16)25-22(26-21(19)28)27-11-5-4-6-17(27)13-29/h7-10,14-15,17,29H,4-6,11-13H2,1-3H3,(H,23,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290588 ((2-Chloro-9-ethyl-9H-purin-6-yl)-phenethyl-amine |...) Show SMILES CCn1cnc2c(NCCc3ccccc3)nc(Cl)nc12 Show InChI InChI=1S/C15H16ClN5/c1-2-21-10-18-12-13(19-15(16)20-14(12)21)17-9-8-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3,(H,17,19,20)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290587 (6-(2-Chloro-9-propyl-9H-purin-6-ylamino)-hexan-1-o...) Show SMILES CCCn1cnc2c(NCCCCCCO)nc(Cl)nc12 Show InChI InChI=1S/C14H22ClN5O/c1-2-8-20-10-17-11-12(18-14(15)19-13(11)20)16-7-5-3-4-6-9-21/h10,21H,2-9H2,1H3,(H,16,18,19)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290598 (2-{(2-Hydroxy-ethyl)-[6-(4-methoxy-benzylamino)-9-...) Show SMILES COc1ccc(CNc2nc(nc3n(Cc4ccc5ccccc5c4)cnc23)N(CCO)CCO)cc1 Show InChI InChI=1S/C28H30N6O3/c1-37-24-10-7-20(8-11-24)17-29-26-25-27(32-28(31-26)33(12-14-35)13-15-36)34(19-30-25)18-21-6-9-22-4-2-3-5-23(22)16-21/h2-11,16,19,35-36H,12-15,17-18H2,1H3,(H,29,31,32)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50009686 ((2-Chloro-9-methyl-9H-purin-6-yl)-cyclopentyl-amin...) Show SMILES Cn1cnc2c(NC3CCCC3)nc(Cl)nc12 Show InChI InChI=1S/C11H14ClN5/c1-17-6-13-8-9(14-7-4-2-3-5-7)15-11(12)16-10(8)17/h6-7H,2-5H2,1H3,(H,14,15,16)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290562 (CHEMBL88694 | N*2*,N*2*-Diallyl-9-isopropyl-N*6*-(...) Show SMILES COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(CC=C)CC=C)cc1 Show InChI InChI=1S/C22H28N6O/c1-6-12-27(13-7-2)22-25-20(19-21(26-22)28(15-24-19)16(3)4)23-14-17-8-10-18(29-5)11-9-17/h6-11,15-16H,1-2,12-14H2,3-5H3,(H,23,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290584 ((2-Chloro-9-cyclopentyl-9H-purin-6-yl)-methyl-pyri...) Show SMILES CN(c1ccncc1)c1nc(Cl)nc2n(cnc12)C1CCCC1 Show InChI InChI=1S/C16H17ClN6/c1-22(11-6-8-18-9-7-11)14-13-15(21-16(17)20-14)23(10-19-13)12-4-2-3-5-12/h6-10,12H,2-5H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290625 (2-[2-(2-Chloro-9H-purin-6-ylamino)-ethyl]-isoindol...) Show SMILES Clc1nc(NCCN2C(=O)c3ccccc3C2=O)c2[nH]cnc2n1 Show InChI InChI=1S/C15H11ClN6O2/c16-15-20-11(10-12(21-15)19-7-18-10)17-5-6-22-13(23)8-3-1-2-4-9(8)14(22)24/h1-4,7H,5-6H2,(H2,17,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290577 ((4-Chloro-butyl)-(2-chloro-9H-purin-6-yl)-amine | ...) Show SMILES ClCCCCNc1nc(Cl)nc2nc[nH]c12 Show InChI InChI=1S/C9H11Cl2N5/c10-3-1-2-4-12-7-6-8(14-5-13-6)16-9(11)15-7/h5H,1-4H2,(H2,12,13,14,15,16)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290620 (3-[2-[Bis-(2-hydroxy-ethyl)-amino]-6-(4-methoxy-be...) Show SMILES COc1ccc(CNc2nc(nc3n(CC(O)CO)cnc23)N(CCO)CCO)cc1 Show InChI InChI=1S/C20H28N6O5/c1-31-16-4-2-14(3-5-16)10-21-18-17-19(26(13-22-17)11-15(30)12-29)24-20(23-18)25(6-8-27)7-9-28/h2-5,13,15,27-30H,6-12H2,1H3,(H,21,23,24)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290574 ((2-Chloro-9-isobutyl-9H-purin-6-yl)-methyl-pyridin...) Show SMILES CC(C)Cn1cnc2c(nc(Cl)nc12)N(C)c1cccnc1 Show InChI InChI=1S/C15H17ClN6/c1-10(2)8-22-9-18-12-13(19-15(16)20-14(12)22)21(3)11-5-4-6-17-7-11/h4-7,9-10H,8H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290576 ((9-Biphenyl-4-ylmethyl-2-chloro-9H-purin-6-yl)-(4-...) Show SMILES COc1ccc(CNc2nc(Cl)nc3n(Cc4ccc(cc4)-c4ccccc4)cnc23)cc1 Show InChI InChI=1S/C26H22ClN5O/c1-33-22-13-9-18(10-14-22)15-28-24-23-25(31-26(27)30-24)32(17-29-23)16-19-7-11-21(12-8-19)20-5-3-2-4-6-20/h2-14,17H,15-16H2,1H3,(H,28,30,31)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290606 ((2-Chloro-9-methyl-9H-purin-6-yl)-(3-methoxy-propy...) Show SMILES COCCCNc1nc(Cl)nc2n(C)cnc12 Show InChI InChI=1S/C10H14ClN5O/c1-16-6-13-7-8(12-4-3-5-17-2)14-10(11)15-9(7)16/h6H,3-5H2,1-2H3,(H,12,14,15)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290617 (2-{(2-Hydroxy-ethyl)-[9-isopropyl-6-(quinolin-8-yl...) Show SMILES CC(C)n1cnc2c(Nc3cccc4cccnc34)nc(nc12)N(CCO)CCO Show InChI InChI=1S/C21H25N7O2/c1-14(2)28-13-23-18-19(24-16-7-3-5-15-6-4-8-22-17(15)16)25-21(26-20(18)28)27(9-11-29)10-12-30/h3-8,13-14,29-30H,9-12H2,1-2H3,(H,24,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2/G1/S-specific cyclin-E1/G1/S-specific cyclin-E2 (Homo sapiens (Human))	BDBM50290572 ((2-Chloro-9-methyl-9H-purin-6-yl)-(2-methoxy-ethyl...) Show SMILES COCCNc1nc(Cl)nc2n(C)cnc12 Show InChI InChI=1S/C9H12ClN5O/c1-15-5-12-6-7(11-3-4-16-2)13-9(10)14-8(6)15/h5H,3-4H2,1-2H3,(H,11,13,14)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Bioorg Med Chem Lett 7: 2697-2702 (1997) Article DOI: 10.1016/S0960-894X(97)10076-2 BindingDB Entry DOI: 10.7270/Q2FJ2H8Q
					More data for this Ligand-Target Pair

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