Compile Data Set for Download or QSAR

Found 114 hits with Last Name = 'keyes' and Initial = 'pe'   

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
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311570 (2-(6-(4-(4-aminopyrimidin-2-yloxy)piperidin-1-yl)-...) Show SMILES Nc1ccnc(OC2CCN(CC2)c2ncnc(Oc3ccccc3C#N)c2F)n1 Show InChI InChI=1S/C20H18FN7O2/c21-17-18(25-12-26-19(17)30-15-4-2-1-3-13(15)11-22)28-9-6-14(7-10-28)29-20-24-8-5-16(23)27-20/h1-5,8,12,14H,6-7,9-10H2,(H2,23,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311564 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Nc1nc(OC2CCN(CC2)c2ncnc(Oc3ccccc3C#N)c2F)ncc1F Show InChI InChI=1S/C20H17F2N7O2/c21-14-10-25-20(28-17(14)24)30-13-5-7-29(8-6-13)18-16(22)19(27-11-26-18)31-15-4-2-1-3-12(15)9-23/h1-4,10-11,13H,5-8H2,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311568 (3-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES COc1ccc(cc1Oc1ncnc(N2CCC(CC2)Oc2ncc(F)c(N)n2)c1F)C#N Show InChI InChI=1S/C21H19F2N7O3/c1-31-15-3-2-12(9-24)8-16(15)33-20-17(23)19(27-11-28-20)30-6-4-13(5-7-30)32-21-26-10-14(22)18(25)29-21/h2-3,8,10-11,13H,4-7H2,1H3,(H2,25,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311609 (CHEMBL1080444 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NC(=O)c1cc(ccn1)-c1cc2ccccc2s1 |r| Show InChI InChI=1S/C23H20FN5O2S/c24-17-12-29(23(31)28-21(17)25)16-6-5-15(11-16)27-22(30)18-9-14(7-8-26-18)20-10-13-3-1-2-4-19(13)32-20/h1-4,7-10,12,15-16H,5-6,11H2,(H,27,30)(H2,25,28,31)/t15-,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311569 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES COc1ccc(Oc2ncnc(N3CCC(CC3)Oc3ncc(F)c(N)n3)c2F)c(c1)C#N Show InChI InChI=1S/C21H19F2N7O3/c1-31-14-2-3-16(12(8-14)9-24)33-20-17(23)19(27-11-28-20)30-6-4-13(5-7-30)32-21-26-10-15(22)18(25)29-21/h2-3,8,10-11,13H,4-7H2,1H3,(H2,25,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311544 (2-(2-(1-(6-(benzo[b]thiophen-2-yl)pyrimidin-4-yl)p...) Show SMILES Nc1nc(OCCC2CCN(CC2)c2cc(ncn2)-c2cc3ccccc3s2)ncc1F Show InChI InChI=1S/C23H23FN6OS/c24-17-13-26-23(29-22(17)25)31-10-7-15-5-8-30(9-6-15)21-12-18(27-14-28-21)20-11-16-3-1-2-4-19(16)32-20/h1-4,11-15H,5-10H2,(H2,25,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311556 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3ccccc3C#N)ncn2)ncc1F Show InChI InChI=1S/C20H18FN7O2/c21-15-11-24-20(27-19(15)23)29-14-5-7-28(8-6-14)17-9-18(26-12-25-17)30-16-4-2-1-3-13(16)10-22/h1-4,9,11-12,14H,5-8H2,(H2,23,24,27)	PDB MMDB 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	3	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311554 (2-(1-(6-(2-chlorophenoxy)pyrimidin-4-yl)piperidin-...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3ccccc3Cl)ncn2)ncc1F Show InChI InChI=1S/C19H18ClFN6O2/c20-13-3-1-2-4-15(13)29-17-9-16(24-11-25-17)27-7-5-12(6-8-27)28-19-23-10-14(21)18(22)26-19/h1-4,9-12H,5-8H2,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311551 (2-(1-(6-(biphenyl-2-yloxy)pyrimidin-4-yl)piperidin...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3ccccc3-c3ccccc3)ncn2)ncc1F Show InChI InChI=1S/C25H23FN6O2/c26-20-15-28-25(31-24(20)27)33-18-10-12-32(13-11-18)22-14-23(30-16-29-22)34-21-9-5-4-8-19(21)17-6-2-1-3-7-17/h1-9,14-16,18H,10-13H2,(H2,27,28,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311560 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES COc1ccc(Oc2cc(ncn2)N2CCC(CC2)Oc2ncc(F)c(N)n2)c(c1)C#N Show InChI InChI=1S/C21H20FN7O3/c1-30-15-2-3-17(13(8-15)10-23)32-19-9-18(26-12-27-19)29-6-4-14(5-7-29)31-21-25-11-16(22)20(24)28-21/h2-3,8-9,11-12,14H,4-7H2,1H3,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311566 (3-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Nc1nc(OC2CCN(CC2)c2ncnc(Oc3cccc(c3)C#N)c2F)ncc1F Show InChI InChI=1S/C20H17F2N7O2/c21-15-10-25-20(28-17(15)24)31-13-4-6-29(7-5-13)18-16(22)19(27-11-26-18)30-14-3-1-2-12(8-14)9-23/h1-3,8,10-11,13H,4-7H2,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311565 (5-fluoro-2-(1-(5-fluoro-6-(4-methoxyphenoxy)pyrimi...) Show SMILES COc1ccc(Oc2ncnc(N3CCC(CC3)Oc3ncc(F)c(N)n3)c2F)cc1 Show InChI InChI=1S/C20H20F2N6O3/c1-29-12-2-4-13(5-3-12)30-19-16(22)18(25-11-26-19)28-8-6-14(7-9-28)31-20-24-10-15(21)17(23)27-20/h2-5,10-11,14H,6-9H2,1H3,(H2,23,24,27)	PDB MMDB 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	4	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311548 (5-fluoro-2-(1-(6-(2-methoxyphenoxy)pyrimidin-4-yl)...) Show SMILES COc1ccccc1Oc1cc(ncn1)N1CCC(CC1)Oc1ncc(F)c(N)n1 Show InChI InChI=1S/C20H21FN6O3/c1-28-15-4-2-3-5-16(15)30-18-10-17(24-12-25-18)27-8-6-13(7-9-27)29-20-23-11-14(21)19(22)26-20/h2-5,10-13H,6-9H2,1H3,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311567 (4-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Nc1nc(OC2CCN(CC2)c2ncnc(Oc3ccc(cc3)C#N)c2F)ncc1F Show InChI InChI=1S/C20H17F2N7O2/c21-15-10-25-20(28-17(15)24)31-14-5-7-29(8-6-14)18-16(22)19(27-11-26-18)30-13-3-1-12(9-23)2-4-13/h1-4,10-11,14H,5-8H2,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311563 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Nc1nc(OC2CCN(CC2)c2ncnc(Oc3ccccc3C#N)c2Br)ncc1F Show InChI InChI=1S/C20H17BrFN7O2/c21-16-18(26-11-27-19(16)31-15-4-2-1-3-12(15)9-23)29-7-5-13(6-8-29)30-20-25-10-14(22)17(24)28-20/h1-4,10-11,13H,5-8H2,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311558 (5-fluoro-2-(1-(6-(2-fluorophenoxy)pyrimidin-4-yl)p...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3ccccc3F)ncn2)ncc1F Show InChI InChI=1S/C19H18F2N6O2/c20-13-3-1-2-4-15(13)29-17-9-16(24-11-25-17)27-7-5-12(6-8-27)28-19-23-10-14(21)18(22)26-19/h1-4,9-12H,5-8H2,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311550 (5-fluoro-2-(1-(6-(o-tolyloxy)pyrimidin-4-yl)piperi...) Show SMILES Cc1ccccc1Oc1cc(ncn1)N1CCC(CC1)Oc1ncc(F)c(N)n1 Show InChI InChI=1S/C20H21FN6O2/c1-13-4-2-3-5-16(13)29-18-10-17(24-12-25-18)27-8-6-14(7-9-27)28-20-23-11-15(21)19(22)26-20/h2-5,10-12,14H,6-9H2,1H3,(H2,22,23,26)	PDB MMDB 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
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311559 (2-(1-(6-(4-chloro-2-methylphenoxy)pyrimidin-4-yl)p...) Show SMILES Cc1cc(Cl)ccc1Oc1cc(ncn1)N1CCC(CC1)Oc1ncc(F)c(N)n1 Show InChI InChI=1S/C20H20ClFN6O2/c1-12-8-13(21)2-3-16(12)30-18-9-17(25-11-26-18)28-6-4-14(5-7-28)29-20-24-10-15(22)19(23)27-20/h2-3,8-11,14H,4-7H2,1H3,(H2,23,24,27)	PDB MMDB 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
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311555 (2-(1-(6-(2-ethylphenoxy)pyrimidin-4-yl)piperidin-4...) Show SMILES CCc1ccccc1Oc1cc(ncn1)N1CCC(CC1)Oc1ncc(F)c(N)n1 Show InChI InChI=1S/C21H23FN6O2/c1-2-14-5-3-4-6-17(14)30-19-11-18(25-13-26-19)28-9-7-15(8-10-28)29-21-24-12-16(22)20(23)27-21/h3-6,11-13,15H,2,7-10H2,1H3,(H2,23,24,27)	PDB MMDB 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
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311562 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Cc1nc(Oc2ccccc2C#N)cc(n1)N1CCC(CC1)Oc1ncc(F)c(N)n1 Show InChI InChI=1S/C21H20FN7O2/c1-13-26-18(10-19(27-13)31-17-5-3-2-4-14(17)11-23)29-8-6-15(7-9-29)30-21-25-12-16(22)20(24)28-21/h2-5,10,12,15H,6-9H2,1H3,(H2,24,25,28)	PDB MMDB 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
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311557 (3-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3cccc(c3)C#N)ncn2)ncc1F Show InChI InChI=1S/C20H18FN7O2/c21-16-11-24-20(27-19(16)23)30-14-4-6-28(7-5-14)17-9-18(26-12-25-17)29-15-3-1-2-13(8-15)10-22/h1-3,8-9,11-12,14H,4-7H2,(H2,23,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311552 (2-(1-(6-(4-chlorophenoxy)pyrimidin-4-yl)piperidin-...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3ccc(Cl)cc3)ncn2)ncc1F Show InChI InChI=1S/C19H18ClFN6O2/c20-12-1-3-13(4-2-12)28-17-9-16(24-11-25-17)27-7-5-14(6-8-27)29-19-23-10-15(21)18(22)26-19/h1-4,9-11,14H,5-8H2,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311561 (2-(6-(4-(4-amino-5-fluoropyrimidin-2-yloxy)piperid...) Show SMILES Cc1c(Oc2ccccc2C#N)ncnc1N1CCC(CC1)Oc1ncc(F)c(N)n1 Show InChI InChI=1S/C21H20FN7O2/c1-13-19(26-12-27-20(13)31-17-5-3-2-4-14(17)10-23)29-8-6-15(7-9-29)30-21-25-11-16(22)18(24)28-21/h2-5,11-12,15H,6-9H2,1H3,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311549 (5-fluoro-2-(1-(6-(p-tolyloxy)pyrimidin-4-yl)piperi...) Show SMILES Cc1ccc(Oc2cc(ncn2)N2CCC(CC2)Oc2ncc(F)c(N)n2)cc1 Show InChI InChI=1S/C20H21FN6O2/c1-13-2-4-14(5-3-13)28-18-10-17(24-12-25-18)27-8-6-15(7-9-27)29-20-23-11-16(21)19(22)26-20/h2-5,10-12,15H,6-9H2,1H3,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311608 (CHEMBL1079784 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Cc1cc(Cl)ccc1-c1cccc(c1)C(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C23H22ClFN4O2/c1-13-9-16(24)5-8-19(13)14-3-2-4-15(10-14)22(30)27-17-6-7-18(11-17)29-12-20(25)21(26)28-23(29)31/h2-5,8-10,12,17-18H,6-7,11H2,1H3,(H,27,30)(H2,26,28,31)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311602 (CHEMBL1079771 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1cccc(c1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C21H19Cl2FN4O3S/c22-13-4-7-17(18(23)9-13)12-2-1-3-16(8-12)32(30,31)27-14-5-6-15(10-14)28-11-19(24)20(25)26-21(28)29/h1-4,7-9,11,14-15,27H,5-6,10H2,(H2,25,26,29)/t14-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311603 (CHEMBL1079432 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Cc1cc(Cl)ccc1-c1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C22H22ClFN4O3S/c1-13-9-15(23)5-8-19(13)14-3-2-4-18(10-14)32(30,31)27-16-6-7-17(11-16)28-12-20(24)21(25)26-22(28)29/h2-5,8-10,12,16-17,27H,6-7,11H2,1H3,(H2,25,26,29)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311553 (2-(1-(6-(3-chlorophenoxy)pyrimidin-4-yl)piperidin-...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3cccc(Cl)c3)ncn2)ncc1F Show InChI InChI=1S/C19H18ClFN6O2/c20-12-2-1-3-14(8-12)28-17-9-16(24-11-25-17)27-6-4-13(5-7-27)29-19-23-10-15(21)18(22)26-19/h1-3,8-11,13H,4-7H2,(H2,22,23,26)	PDB MMDB 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
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311547 (5-fluoro-2-(1-(6-(3-methoxyphenoxy)pyrimidin-4-yl)...) Show SMILES COc1cccc(Oc2cc(ncn2)N2CCC(CC2)Oc2ncc(F)c(N)n2)c1 Show InChI InChI=1S/C20H21FN6O3/c1-28-14-3-2-4-15(9-14)29-18-10-17(24-12-25-18)27-7-5-13(6-8-27)30-20-23-11-16(21)19(22)26-20/h2-4,9-13H,5-8H2,1H3,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311607 (CHEMBL1076274 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NC(=O)c1cccc(c1)-c1cccc(Cl)c1 |r| Show InChI InChI=1S/C22H20ClFN4O2/c23-16-6-2-4-14(10-16)13-3-1-5-15(9-13)21(29)26-17-7-8-18(11-17)28-12-19(24)20(25)27-22(28)30/h1-6,9-10,12,17-18H,7-8,11H2,(H,26,29)(H2,25,27,30)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311605 (CHEMBL1079600 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES COc1ccc(cc1)-c1cccc(c1)C(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C23H23FN4O3/c1-31-19-9-5-14(6-10-19)15-3-2-4-16(11-15)22(29)26-17-7-8-18(12-17)28-13-20(24)21(25)27-23(28)30/h2-6,9-11,13,17-18H,7-8,12H2,1H3,(H,26,29)(H2,25,27,30)/t17-,18-/m0/s1	PDB MMDB 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
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311546 (5-fluoro-2-(1-(6-(4-methoxyphenoxy)pyrimidin-4-yl)...) Show SMILES COc1ccc(Oc2cc(ncn2)N2CCC(CC2)Oc2ncc(F)c(N)n2)cc1 Show InChI InChI=1S/C20H21FN6O3/c1-28-13-2-4-14(5-3-13)29-18-10-17(24-12-25-18)27-8-6-15(7-9-27)30-20-23-11-16(21)19(22)26-20/h2-5,10-12,15H,6-9H2,1H3,(H2,22,23,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311543 (2-((1-(6-(benzo[b]thiophen-2-yl)pyrimidin-4-yl)pip...) Show SMILES Nc1nc(OCC2CCN(CC2)c2cc(ncn2)-c2cc3ccccc3s2)ncc1F Show InChI InChI=1S/C22H21FN6OS/c23-16-11-25-22(28-21(16)24)30-12-14-5-7-29(8-6-14)20-10-17(26-13-27-20)19-9-15-3-1-2-4-18(15)31-19/h1-4,9-11,13-14H,5-8,12H2,(H2,24,25,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD 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
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311542 (2-(1-(6-(benzo[b]thiophen-2-yl)pyrimidin-4-yl)pipe...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(ncn2)-c2cc3ccccc3s2)ncc1F Show InChI InChI=1S/C21H19FN6OS/c22-15-11-24-21(27-20(15)23)29-14-5-7-28(8-6-14)19-10-16(25-12-26-19)18-9-13-3-1-2-4-17(13)30-18/h1-4,9-12,14H,5-8H2,(H2,23,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311606 (CHEMBL1079783 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NC(=O)c1cccc(c1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C22H20ClFN4O2/c23-16-6-4-13(5-7-16)14-2-1-3-15(10-14)21(29)26-17-8-9-18(11-17)28-12-19(24)20(25)27-22(28)30/h1-7,10,12,17-18H,8-9,11H2,(H,26,29)(H2,25,27,30)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD 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
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311601 (CHEMBL1079415 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1cccc(c1)-c1ccccc1Cl |r| Show InChI InChI=1S/C21H20ClFN4O3S/c22-18-7-2-1-6-17(18)13-4-3-5-16(10-13)31(29,30)26-14-8-9-15(11-14)27-12-19(23)20(24)25-21(27)28/h1-7,10,12,14-15,26H,8-9,11H2,(H2,24,25,28)/t14-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311595 (CHEMBL1079397 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1cccc(c1)-c1ccc(cc1)C#N |r| Show InChI InChI=1S/C22H20FN5O3S/c23-20-13-28(22(29)26-21(20)25)18-9-8-17(11-18)27-32(30,31)19-3-1-2-16(10-19)15-6-4-14(12-24)5-7-15/h1-7,10,13,17-18,27H,8-9,11H2,(H2,25,26,29)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311599 (CHEMBL1079759 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1cccc(c1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C21H20ClFN4O3S/c22-15-6-4-13(5-7-15)14-2-1-3-18(10-14)31(29,30)26-16-8-9-17(11-16)27-12-19(23)20(24)25-21(27)28/h1-7,10,12,16-17,26H,8-9,11H2,(H2,24,25,28)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311571 (2-(6-(4-(4-amino-2-oxopyrimidin-1(2H)-yloxy)piperi...) Show SMILES Nc1ccn(OC2CCN(CC2)c2ncnc(Oc3ccccc3C#N)c2F)c(=O)n1 Show InChI InChI=1S/C20H18FN7O3/c21-17-18(24-12-25-19(17)30-15-4-2-1-3-13(15)11-22)27-8-5-14(6-9-27)31-28-10-7-16(23)26-20(28)29/h1-4,7,10,12,14H,5-6,8-9H2,(H2,23,26,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311596 (CHEMBL1079398 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C22H23FN4O5S2/c1-33(29,30)18-9-5-14(6-10-18)15-3-2-4-19(11-15)34(31,32)26-16-7-8-17(12-16)27-13-20(23)21(24)25-22(27)28/h2-6,9-11,13,16-17,26H,7-8,12H2,1H3,(H2,24,25,28)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311594 (CHEMBL1082101 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES COc1ccc(cc1)-c1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C22H23FN4O4S/c1-31-18-9-5-14(6-10-18)15-3-2-4-19(11-15)32(29,30)26-16-7-8-17(12-16)27-13-20(23)21(24)25-22(27)28/h2-6,9-11,13,16-17,26H,7-8,12H2,1H3,(H2,24,25,28)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311600 (CHEMBL1079760 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1cccc(c1)-c1cccc(Cl)c1 |r| Show InChI InChI=1S/C21H20ClFN4O3S/c22-15-5-1-3-13(9-15)14-4-2-6-18(10-14)31(29,30)26-16-7-8-17(11-16)27-12-19(23)20(24)25-21(27)28/h1-6,9-10,12,16-17,26H,7-8,11H2,(H2,24,25,28)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311597 (3'-(N-((1S,3S)-3-(4-amino-5-fluoro-2-oxopyrimidin-...) Show SMILES NC(=O)c1ccc(cc1)-c1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C22H22FN5O4S/c23-19-12-28(22(30)26-20(19)24)17-9-8-16(11-17)27-33(31,32)18-3-1-2-15(10-18)13-4-6-14(7-5-13)21(25)29/h1-7,10,12,16-17,27H,8-9,11H2,(H2,25,29)(H2,24,26,30)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311545 (5-fluoro-2-(1-(6-phenoxypyrimidin-4-yl)piperidin-4...) Show SMILES Nc1nc(OC2CCN(CC2)c2cc(Oc3ccccc3)ncn2)ncc1F Show InChI InChI=1S/C19H19FN6O2/c20-15-11-22-19(25-18(15)21)28-14-6-8-26(9-7-14)16-10-17(24-12-23-16)27-13-4-2-1-3-5-13/h1-5,10-12,14H,6-9H2,(H2,21,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311593 (CHEMBL1081189 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Cc1ccc(cc1)-c1cccc(c1)S(=O)(=O)N[C@H]1CC[C@@H](C1)n1cc(F)c(N)nc1=O |r| Show InChI InChI=1S/C22H23FN4O3S/c1-14-5-7-15(8-6-14)16-3-2-4-19(11-16)31(29,30)26-17-9-10-18(12-17)27-13-20(23)21(24)25-22(27)28/h2-8,11,13,17-18,26H,9-10,12H2,1H3,(H2,24,25,28)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311592 (CHEMBL1081006 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1cccc(c1)-c1ccccc1 |r| Show InChI InChI=1S/C21H21FN4O3S/c22-19-13-26(21(27)24-20(19)23)17-10-9-16(12-17)25-30(28,29)18-8-4-7-15(11-18)14-5-2-1-3-6-14/h1-8,11,13,16-17,25H,9-10,12H2,(H2,23,24,27)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311604 (CHEMBL1079433 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NC(=O)c1cccc(c1)-c1ccccc1 |r| Show InChI InChI=1S/C22H21FN4O2/c23-19-13-27(22(29)26-20(19)24)18-10-9-17(12-18)25-21(28)16-8-4-7-15(11-16)14-5-2-1-3-6-14/h1-8,11,13,17-18H,9-10,12H2,(H,25,28)(H2,24,26,29)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311590 (CHEMBL1081909 | N-((1S,3S)-3-(4-amino-5-fluoro-2-o...) Show SMILES Nc1nc(=O)n(cc1F)[C@H]1CC[C@@H](C1)NS(=O)(=O)c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C21H21FN4O3S/c22-19-13-26(21(27)24-20(19)23)17-9-8-16(12-17)25-30(28,29)18-10-6-15(7-11-18)14-4-2-1-3-5-14/h1-7,10-11,13,16-17,25H,8-9,12H2,(H2,23,24,27)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311539 (2-(4-(6-(benzo[b]thiophen-2-yl)pyrimidin-4-yl)pipe...) Show SMILES O=C(CN1CCN(CC1)c1cc(ncn1)-c1cc2ccccc2s1)N1CCCC1 Show InChI InChI=1S/C22H25N5OS/c28-22(27-7-3-4-8-27)15-25-9-11-26(12-10-25)21-14-18(23-16-24-21)20-13-17-5-1-2-6-19(17)29-20/h1-2,5-6,13-14,16H,3-4,7-12,15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem	MMDB PDB Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human deoxycytidine kinase by lysate filter binding assay				Bioorg Med Chem Lett 19: 6784-7 (2009) Article DOI: 10.1016/j.bmcl.2009.09.081 BindingDB Entry DOI: 10.7270/Q2CV4HVK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50311541 (2-(6-(benzo[b]thiophen-2-yl)pyrimidin-4-yloxy)-5-f...) Show SMILES Nc1nc(Oc2cc(ncn2)-c2cc3ccccc3s2)ncc1F Show InChI InChI=1S/C16H10FN5OS/c17-10-7-19-16(22-15(10)18)23-14-6-11(20-8-21-14)13-5-9-3-1-2-4-12(9)24-13/h1-8H,(H2,18,19,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Princ Curated by ChEMBL					Assay Description Inhibition of human dCK				Bioorg Med Chem Lett 19: 6780-3 (2009) Article DOI: 10.1016/j.bmcl.2009.09.082 BindingDB Entry DOI: 10.7270/Q2HM58K9
					More data for this Ligand-Target Pair

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