Compile Data Set for Download or QSAR

Found 46 hits Enz. Inhib. hit(s) with all data for entry = 50040946   

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
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402647 (CHEMBL2206732) Show SMILES Oc1c(Br)cc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3cc(Br)c(O)c(Br)c3)=NC2=O)cc1Br |w:6.5,25.26,c:36,t:19| Show InChI InChI=1S/C27H24Br4N4O4S2/c28-16-8-14(9-17(29)22(16)36)12-20-24(38)34-26(40-20)32-6-4-2-1-3-5-7-33-27-35-25(39)21(41-27)13-15-10-18(30)23(37)19(31)11-15/h8-13,36-37H,1-7H2,(H,32,34,38)(H,33,35,39)	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	1.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402654 (CHEMBL2207337) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:37,t:19| Show InChI InChI=1S/C28H30N6O4S2/c35-21-5-1-19(2-6-21)17-23-25(37)31-27(39-23)29-9-11-33-13-15-34(16-14-33)12-10-30-28-32-26(38)24(40-28)18-20-3-7-22(36)8-4-20/h1-8,17-18,35-36H,9-16H2,(H,29,31,37)(H,30,32,38)	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	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM24778 (2-methyl-1,4-dihydronaphthalene-1,4-dione | 2-meth...) Show SMILES CC1=CC(=O)c2ccccc2C1=O |t:1| Show InChI InChI=1S/C11H8O2/c1-7-6-10(12)8-4-2-3-5-9(8)11(7)13/h2-6H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402665 (CHEMBL2206740) Show SMILES O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccc(o2)-c2ccccc2)SC1=Cc1ccc(o1)-c1ccccc1 |w:33.37,19.20,t:2,13| Show InChI InChI=1S/C35H32N4O4S2/c40-32-30(22-26-16-18-28(42-26)24-12-6-4-7-13-24)44-34(38-32)36-20-10-2-1-3-11-21-37-35-39-33(41)31(45-35)23-27-17-19-29(43-27)25-14-8-5-9-15-25/h4-9,12-19,22-23H,1-3,10-11,20-21H2,(H,36,38,40)(H,37,39,41)	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	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402650 (CHEMBL2206756) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,26.27,c:35,t:20| Show InChI InChI=1S/C29H32N4O4S2/c34-22-12-8-20(9-13-22)18-24-26(36)32-28(38-24)30-16-6-4-2-1-3-5-7-17-31-29-33-27(37)25(39-29)19-21-10-14-23(35)15-11-21/h8-15,18-19,34-35H,1-7,16-17H2,(H,30,32,36)(H,31,33,37)	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	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402653 (CHEMBL2206734) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)c(O)c3)=NC2=O)cc1O |w:5.4,24.25,c:34,t:18| Show InChI InChI=1S/C27H28N4O6S2/c32-18-8-6-16(12-20(18)34)14-22-24(36)30-26(38-22)28-10-4-2-1-3-5-11-29-27-31-25(37)23(39-27)15-17-7-9-19(33)21(35)13-17/h6-9,12-15,32-35H,1-5,10-11H2,(H,28,30,36)(H,29,31,37)	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	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402660 (CHEMBL2206745) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4ccc5n[nH]cc5c4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:40,t:19| Show InChI InChI=1S/C29H30N8O3S2/c38-22-4-1-19(2-5-22)16-24-26(39)33-28(41-24)30-7-9-36-11-13-37(14-12-36)10-8-31-29-34-27(40)25(42-29)17-20-3-6-23-21(15-20)18-32-35-23/h1-6,15-18,38H,7-14H2,(H,32,35)(H,30,33,39)(H,31,34,40)	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	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402664 (CHEMBL2206741) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4cc(Br)c(O)c(Br)c4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:39,t:19| Show InChI InChI=1S/C28H28Br2N6O4S2/c29-20-13-18(14-21(30)24(20)38)16-23-26(40)34-28(42-23)32-6-8-36-11-9-35(10-12-36)7-5-31-27-33-25(39)22(41-27)15-17-1-3-19(37)4-2-17/h1-4,13-16,37-38H,5-12H2,(H,31,33,39)(H,32,34,40)	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	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402647 (CHEMBL2206732) Show SMILES Oc1c(Br)cc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3cc(Br)c(O)c(Br)c3)=NC2=O)cc1Br |w:6.5,25.26,c:36,t:19| Show InChI InChI=1S/C27H24Br4N4O4S2/c28-16-8-14(9-17(29)22(16)36)12-20-24(38)34-26(40-20)32-6-4-2-1-3-5-7-33-27-35-25(39)21(41-27)13-15-10-18(30)23(37)19(31)11-15/h8-13,36-37H,1-7H2,(H,32,34,38)(H,33,35,39)	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	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 10 mM dithio...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402647 (CHEMBL2206732) Show SMILES Oc1c(Br)cc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3cc(Br)c(O)c(Br)c3)=NC2=O)cc1Br |w:6.5,25.26,c:36,t:19| Show InChI InChI=1S/C27H24Br4N4O4S2/c28-16-8-14(9-17(29)22(16)36)12-20-24(38)34-26(40-20)32-6-4-2-1-3-5-7-33-27-35-25(39)21(41-27)13-15-10-18(30)23(37)19(31)11-15/h8-13,36-37H,1-7H2,(H,32,34,38)(H,33,35,39)	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	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 20 mM dithio...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402648 (CHEMBL2206754) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,24.25,c:33,t:18| Show InChI InChI=1S/C27H28N4O4S2/c32-20-10-6-18(7-11-20)16-22-24(34)30-26(36-22)28-14-4-2-1-3-5-15-29-27-31-25(35)23(37-27)17-19-8-12-21(33)13-9-19/h6-13,16-17,32-33H,1-5,14-15H2,(H,28,30,34)(H,29,31,35)	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	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402658 (CHEMBL2206753) Show SMILES Oc1ccc(C=C2SC(NCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,23.24,c:32,t:17| Show InChI InChI=1S/C26H26N4O4S2/c31-19-9-5-17(6-10-19)15-21-23(33)29-25(35-21)27-13-3-1-2-4-14-28-26-30-24(34)22(36-26)16-18-7-11-20(32)12-8-18/h5-12,15-16,31-32H,1-4,13-14H2,(H,27,29,33)(H,28,30,34)	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	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402657 (CHEMBL2206755) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,25.26,c:34,t:19| Show InChI InChI=1S/C28H30N4O4S2/c33-21-11-7-19(8-12-21)17-23-25(35)31-27(37-23)29-15-5-3-1-2-4-6-16-30-28-32-26(36)24(38-28)18-20-9-13-22(34)14-10-20/h7-14,17-18,33-34H,1-6,15-16H2,(H,29,31,35)(H,30,32,36)	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	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402663 (CHEMBL2206742) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4ccc5OCOc5c4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:40,t:19| Show InChI InChI=1S/C29H30N6O5S2/c36-21-4-1-19(2-5-21)16-24-26(37)32-28(41-24)30-7-9-34-11-13-35(14-12-34)10-8-31-29-33-27(38)25(42-29)17-20-3-6-22-23(15-20)40-18-39-22/h1-6,15-17,36H,7-14,18H2,(H,30,32,37)(H,31,33,38)	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	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402650 (CHEMBL2206756) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,26.27,c:35,t:20| Show InChI InChI=1S/C29H32N4O4S2/c34-22-12-8-20(9-13-22)18-24-26(36)32-28(38-24)30-16-6-4-2-1-3-5-7-17-31-29-33-27(37)25(39-29)19-21-10-14-23(35)15-11-21/h8-15,18-19,34-35H,1-7,16-17H2,(H,30,32,36)(H,31,33,37)	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	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402656 (CHEMBL2207335) Show SMILES Oc1ccc(C=C2SC(NCC3CCCC(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)C3)=NC2=O)cc1 |w:5.4,24.25,c:35,t:18| Show InChI InChI=1S/C28H28N4O4S2/c33-21-8-4-17(5-9-21)13-23-25(35)31-27(37-23)29-15-19-2-1-3-20(12-19)16-30-28-32-26(36)24(38-28)14-18-6-10-22(34)11-7-18/h4-11,13-14,19-20,33-34H,1-3,12,15-16H2,(H,29,31,35)(H,30,32,36)	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	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402655 (CHEMBL2207336) Show SMILES Oc1ccc(C=C2SC(NCc3cccc(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)c3)=NC2=O)cc1 |w:5.4,24.25,c:35,t:18| Show InChI InChI=1S/C28H22N4O4S2/c33-21-8-4-17(5-9-21)13-23-25(35)31-27(37-23)29-15-19-2-1-3-20(12-19)16-30-28-32-26(36)24(38-28)14-18-6-10-22(34)11-7-18/h1-14,33-34H,15-16H2,(H,29,31,35)(H,30,32,36)	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	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402666 (CHEMBL2206739) Show SMILES O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=CC=Cc2ccccc2)SC1=CC=Cc1ccccc1 |w:29.31,31.33,17.16,20.20,t:2,13| Show InChI InChI=1S/C31H32N4O2S2/c36-28-26(20-12-18-24-14-6-4-7-15-24)38-30(34-28)32-22-10-2-1-3-11-23-33-31-35-29(37)27(39-31)21-13-19-25-16-8-5-9-17-25/h4-9,12-21H,1-3,10-11,22-23H2,(H,32,34,36)(H,33,35,37)	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	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402659 (CHEMBL2206751) Show SMILES Oc1ccc(C=C2SC(NCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,21.22,c:30,t:15| Show InChI InChI=1S/C24H22N4O4S2/c29-17-7-3-15(4-8-17)13-19-21(31)27-23(33-19)25-11-1-2-12-26-24-28-22(32)20(34-24)14-16-5-9-18(30)10-6-16/h3-10,13-14,29-30H,1-2,11-12H2,(H,25,27,31)(H,26,28,32)	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	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402661 (CHEMBL2206744) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=CC=Cc4ccco4)CC3)=NC2=O)cc1 |w:23.22,5.4,26.26,c:37,t:19| Show InChI InChI=1S/C28H30N6O4S2/c35-21-8-6-20(7-9-21)19-24-26(37)32-28(40-24)30-11-13-34-16-14-33(15-17-34)12-10-29-27-31-25(36)23(39-27)5-1-3-22-4-2-18-38-22/h1-9,18-19,35H,10-17H2,(H,29,31,36)(H,30,32,37)	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	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402656 (CHEMBL2207335) Show SMILES Oc1ccc(C=C2SC(NCC3CCCC(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)C3)=NC2=O)cc1 |w:5.4,24.25,c:35,t:18| Show InChI InChI=1S/C28H28N4O4S2/c33-21-8-4-17(5-9-21)13-23-25(35)31-27(37-23)29-15-19-2-1-3-20(12-19)16-30-28-32-26(36)24(38-28)14-18-6-10-22(34)11-7-18/h4-11,13-14,19-20,33-34H,1-3,12,15-16H2,(H,29,31,35)(H,30,32,36)	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	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402655 (CHEMBL2207336) Show SMILES Oc1ccc(C=C2SC(NCc3cccc(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)c3)=NC2=O)cc1 |w:5.4,24.25,c:35,t:18| Show InChI InChI=1S/C28H22N4O4S2/c33-21-8-4-17(5-9-21)13-23-25(35)31-27(37-23)29-15-19-2-1-3-20(12-19)16-30-28-32-26(36)24(38-28)14-18-6-10-22(34)11-7-18/h1-14,33-34H,15-16H2,(H,29,31,35)(H,30,32,36)	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	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402668 (CHEMBL2206731) Show SMILES Oc1ccc(C=C2SC(NCCCc3cn(CCCNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)nn3)=NC2=O)cc1 |w:26.27,5.4,c:38,t:20| Show InChI InChI=1S/C28H27N7O4S2/c36-21-8-4-18(5-9-21)15-23-25(38)31-27(40-23)29-12-1-3-20-17-35(34-33-20)14-2-13-30-28-32-26(39)24(41-28)16-19-6-10-22(37)11-7-19/h4-11,15-17,36-37H,1-3,12-14H2,(H,29,31,38)(H,30,32,39)	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	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402657 (CHEMBL2206755) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,25.26,c:34,t:19| Show InChI InChI=1S/C28H30N4O4S2/c33-21-11-7-19(8-12-21)17-23-25(35)31-27(37-23)29-15-5-3-1-2-4-6-16-30-28-32-26(36)24(38-28)18-20-9-13-22(34)14-10-20/h7-14,17-18,33-34H,1-6,15-16H2,(H,29,31,35)(H,30,32,36)	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	1.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402649 (CHEMBL2206736) Show SMILES OC(=O)C=Cc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(C=CC(O)=O)cc3)=NC2=O)cc1 |w:4.4,34.35,28.29,9.8,c:41,t:22| Show InChI InChI=1S/C33H32N4O6S2/c38-28(39)16-14-22-6-10-24(11-7-22)20-26-30(42)36-32(44-26)34-18-4-2-1-3-5-19-35-33-37-31(43)27(45-33)21-25-12-8-23(9-13-25)15-17-29(40)41/h6-17,20-21H,1-5,18-19H2,(H,38,39)(H,40,41)(H,34,36,42)(H,35,37,43)	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	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase 3 (Homo sapiens (Human))	BDBM50402649 (CHEMBL2206736) Show SMILES OC(=O)C=Cc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(C=CC(O)=O)cc3)=NC2=O)cc1 |w:4.4,34.35,28.29,9.8,c:41,t:22| Show InChI InChI=1S/C33H32N4O6S2/c38-28(39)16-14-22-6-10-24(11-7-22)20-26-30(42)36-32(44-26)34-18-4-2-1-3-5-19-35-33-37-31(43)27(45-33)21-25-12-8-23(9-13-25)15-17-29(40)41/h6-17,20-21H,1-5,18-19H2,(H,38,39)(H,40,41)(H,34,36,42)(H,35,37,43)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of VHR using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402658 (CHEMBL2206753) Show SMILES Oc1ccc(C=C2SC(NCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,23.24,c:32,t:17| Show InChI InChI=1S/C26H26N4O4S2/c31-19-9-5-17(6-10-19)15-21-23(33)29-25(35-21)27-13-3-1-2-4-14-28-26-30-24(34)22(36-26)16-18-7-11-20(32)12-8-18/h5-12,15-16,31-32H,1-4,13-14H2,(H,27,29,33)(H,28,30,34)	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	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402667 (CHEMBL2206737) Show SMILES O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccc3OCOc3c2)SC1=Cc1ccc2OCOc2c1 |w:31.35,19.20,t:2,13| Show InChI InChI=1S/C29H28N4O6S2/c34-26-24(14-18-6-8-20-22(12-18)38-16-36-20)40-28(32-26)30-10-4-2-1-3-5-11-31-29-33-27(35)25(41-29)15-19-7-9-21-23(13-19)39-17-37-21/h6-9,12-15H,1-5,10-11,16-17H2,(H,30,32,34)(H,31,33,35)	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	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402651 (CHEMBL2206752) Show SMILES Oc1ccc(C=C2SC(NCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,22.23,c:31,t:16| Show InChI InChI=1S/C25H24N4O4S2/c30-18-8-4-16(5-9-18)14-20-22(32)28-24(34-20)26-12-2-1-3-13-27-25-29-23(33)21(35-25)15-17-6-10-19(31)11-7-17/h4-11,14-15,30-31H,1-3,12-13H2,(H,26,28,32)(H,27,29,33)	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	1.39E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402648 (CHEMBL2206754) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,24.25,c:33,t:18| Show InChI InChI=1S/C27H28N4O4S2/c32-20-10-6-18(7-11-20)16-22-24(34)30-26(36-22)28-14-4-2-1-3-5-15-29-27-31-25(35)23(37-27)17-19-8-12-21(33)13-9-19/h6-13,16-17,32-33H,1-5,14-15H2,(H,28,30,34)(H,29,31,35)	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	1.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 10 mM dithio...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402648 (CHEMBL2206754) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,24.25,c:33,t:18| Show InChI InChI=1S/C27H28N4O4S2/c32-20-10-6-18(7-11-20)16-22-24(34)30-26(36-22)28-14-4-2-1-3-5-15-29-27-31-25(35)23(37-27)17-19-8-12-21(33)13-9-19/h6-13,16-17,32-33H,1-5,14-15H2,(H,28,30,34)(H,29,31,35)	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	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 20 mM dithio...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402651 (CHEMBL2206752) Show SMILES Oc1ccc(C=C2SC(NCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,22.23,c:31,t:16| Show InChI InChI=1S/C25H24N4O4S2/c30-18-8-4-16(5-9-18)14-20-22(32)28-24(34-20)26-12-2-1-3-13-27-25-29-23(33)21(35-25)15-17-6-10-19(31)11-7-17/h4-11,14-15,30-31H,1-3,12-13H2,(H,26,28,32)(H,27,29,33)	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	2.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402669 (CHEMBL2206730) Show SMILES Oc1ccc(C=C2SC(NCCCn3cc(CCNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)nn3)=NC2=O)cc1 |w:5.4,25.26,c:37,t:19| Show InChI InChI=1S/C27H25N7O4S2/c35-20-6-2-17(3-7-20)14-22-24(37)30-26(39-22)28-11-1-13-34-16-19(32-33-34)10-12-29-27-31-25(38)23(40-27)15-18-4-8-21(36)9-5-18/h2-9,14-16,35-36H,1,10-13H2,(H,28,30,37)(H,29,31,38)	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	2.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402652 (CHEMBL2206735) Show SMILES O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccccc2)SC1=Cc1ccccc1 |w:28.31,19.20,t:2,13| Show InChI InChI=1S/C27H28N4O2S2/c32-24-22(18-20-12-6-4-7-13-20)34-26(30-24)28-16-10-2-1-3-11-17-29-27-31-25(33)23(35-27)19-21-14-8-5-9-15-21/h4-9,12-15,18-19H,1-3,10-11,16-17H2,(H,28,30,32)(H,29,31,33)	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	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402653 (CHEMBL2206734) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)c(O)c3)=NC2=O)cc1O |w:5.4,24.25,c:34,t:18| Show InChI InChI=1S/C27H28N4O6S2/c32-18-8-6-16(12-20(18)34)14-22-24(36)30-26(38-22)28-10-4-2-1-3-5-11-29-27-31-25(37)23(39-27)15-17-7-9-19(33)21(35)13-17/h6-9,12-15,32-35H,1-5,10-11H2,(H,28,30,36)(H,29,31,37)	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	2.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402647 (CHEMBL2206732) Show SMILES Oc1c(Br)cc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3cc(Br)c(O)c(Br)c3)=NC2=O)cc1Br |w:6.5,25.26,c:36,t:19| Show InChI InChI=1S/C27H24Br4N4O4S2/c28-16-8-14(9-17(29)22(16)36)12-20-24(38)34-26(40-20)32-6-4-2-1-3-5-7-33-27-35-25(39)21(41-27)13-15-10-18(30)23(37)19(31)11-15/h8-13,36-37H,1-7H2,(H,32,34,38)(H,33,35,39)	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	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402649 (CHEMBL2206736) Show SMILES OC(=O)C=Cc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(C=CC(O)=O)cc3)=NC2=O)cc1 |w:4.4,34.35,28.29,9.8,c:41,t:22| Show InChI InChI=1S/C33H32N4O6S2/c38-28(39)16-14-22-6-10-24(11-7-22)20-26-30(42)36-32(44-26)34-18-4-2-1-3-5-19-35-33-37-31(43)27(45-33)21-25-12-8-23(9-13-25)15-17-29(40)41/h6-17,20-21H,1-5,18-19H2,(H,38,39)(H,40,41)(H,34,36,42)(H,35,37,43)	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	2.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402659 (CHEMBL2206751) Show SMILES Oc1ccc(C=C2SC(NCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,21.22,c:30,t:15| Show InChI InChI=1S/C24H22N4O4S2/c29-17-7-3-15(4-8-17)13-19-21(31)27-23(33-19)25-11-1-2-12-26-24-28-22(32)20(34-24)14-16-5-9-18(30)10-6-16/h3-10,13-14,29-30H,1-2,11-12H2,(H,25,27,31)(H,26,28,32)	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	2.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402648 (CHEMBL2206754) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,24.25,c:33,t:18| Show InChI InChI=1S/C27H28N4O4S2/c32-20-10-6-18(7-11-20)16-22-24(34)30-26(36-22)28-14-4-2-1-3-5-15-29-27-31-25(35)23(37-27)17-19-8-12-21(33)13-9-19/h6-13,16-17,32-33H,1-5,14-15H2,(H,28,30,34)(H,29,31,35)	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	3.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase 3 (Homo sapiens (Human))	BDBM50402650 (CHEMBL2206756) Show SMILES Oc1ccc(C=C2SC(NCCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,26.27,c:35,t:20| Show InChI InChI=1S/C29H32N4O4S2/c34-22-12-8-20(9-13-22)18-24-26(36)32-28(38-24)30-16-6-4-2-1-3-5-7-17-31-29-33-27(37)25(39-29)19-21-10-14-23(35)15-11-21/h8-15,18-19,34-35H,1-7,16-17H2,(H,30,32,36)(H,31,33,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of VHR using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402670 (CHEMBL2206729) Show SMILES Oc1ccc(C=C2SC(NCCCn3cc(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)nn3)=NC2=O)cc1 |w:24.25,5.4,c:36,t:18| Show InChI InChI=1S/C26H23N7O4S2/c34-19-6-2-16(3-7-19)12-21-23(36)29-25(38-21)27-10-1-11-33-15-18(31-32-33)14-28-26-30-24(37)22(39-26)13-17-4-8-20(35)9-5-17/h2-9,12-13,15,34-35H,1,10-11,14H2,(H,27,29,36)(H,28,30,37)	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	4.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402652 (CHEMBL2206735) Show SMILES O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccccc2)SC1=Cc1ccccc1 |w:28.31,19.20,t:2,13| Show InChI InChI=1S/C27H28N4O2S2/c32-24-22(18-20-12-6-4-7-13-20)34-26(30-24)28-16-10-2-1-3-11-17-29-27-31-25(33)23(35-27)19-21-14-8-5-9-15-21/h4-9,12-15,18-19H,1-3,10-11,16-17H2,(H,28,30,32)(H,29,31,33)	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	4.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50402654 (CHEMBL2207337) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:37,t:19| Show InChI InChI=1S/C28H30N6O4S2/c35-21-5-1-19(2-6-21)17-23-25(37)31-27(39-23)29-9-11-33-13-15-34(16-14-33)12-10-30-28-32-26(38)24(40-28)18-20-3-7-22(36)8-4-20/h1-8,17-18,35-36H,9-16H2,(H,29,31,37)(H,30,32,38)	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	4.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of PTP1B using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402671 (CHEMBL2206728) Show SMILES Oc1ccc(C=C2SC(NCCCc3cn(CCNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)nn3)=NC2=O)cc1 |w:25.26,5.4,c:37,t:19| Show InChI InChI=1S/C27H25N7O4S2/c35-20-7-3-17(4-8-20)14-22-24(37)30-26(39-22)28-11-1-2-19-16-34(33-32-19)13-12-29-27-31-25(38)23(40-27)15-18-5-9-21(36)10-6-18/h3-10,14-16,35-36H,1-2,11-13H2,(H,28,30,37)(H,29,31,38)	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	4.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402662 (CHEMBL2206743) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=CC=Cc4ccccc4)CC3)=NC2=O)cc1 |w:23.22,5.4,26.26,c:38,t:19| Show InChI InChI=1S/C30H32N6O3S2/c37-24-11-9-23(10-12-24)21-26-28(39)34-30(41-26)32-14-16-36-19-17-35(18-20-36)15-13-31-29-33-27(38)25(40-29)8-4-7-22-5-2-1-3-6-22/h1-12,21,37H,13-20H2,(H,31,33,38)(H,32,34,39)	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	5.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase 3 (Homo sapiens (Human))	BDBM50402651 (CHEMBL2206752) Show SMILES Oc1ccc(C=C2SC(NCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,22.23,c:31,t:16| Show InChI InChI=1S/C25H24N4O4S2/c30-18-8-4-16(5-9-18)14-20-22(32)28-24(34-20)26-12-2-1-3-13-27-25-29-23(33)21(35-25)15-17-6-10-19(31)11-7-17/h4-11,14-15,30-31H,1-3,12-13H2,(H,26,28,32)(H,27,29,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of VHR using fluorescein 3,6 diphosphate as substrate measured for 1 hr in presence of 1 mM dithiothreitol				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
					More data for this Ligand-Target Pair