Compile Data Set for Download or QSAR

Found 12 hits Enz. Inhib. hit(s) with Target = 'Ubiquitin-like domain-containing CTD phosphatase 1' AND taxid = 9606   

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
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087856 (CHEMBL3426913) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1ccccc1OC(F)(F)F)C(O)=O)C(=O)NC1CCCCC1 Show InChI InChI=1S/C28H30F3NO6/c1-2-3-12-24(26(34)32-20-10-5-4-6-11-20)37-25-17-22(33)21(27(35)36)16-19(25)15-14-18-9-7-8-13-23(18)38-28(29,30)31/h7-9,13,16-17,20,24,33H,2-6,10-12H2,1H3,(H,32,34)(H,35,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Competitive inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells by Lineweaver-Burk plot analysis in presence o...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087856 (CHEMBL3426913) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1ccccc1OC(F)(F)F)C(O)=O)C(=O)NC1CCCCC1 Show InChI InChI=1S/C28H30F3NO6/c1-2-3-12-24(26(34)32-20-10-5-4-6-11-20)37-25-17-22(33)21(27(35)36)16-19(25)15-14-18-9-7-8-13-23(18)38-28(29,30)31/h7-9,13,16-17,20,24,33H,2-6,10-12H2,1H3,(H,32,34)(H,35,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087858 (CHEMBL3425525) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1ccccc1OC)C(O)=O)C(=O)NC1CCCCCCC1 Show InChI InChI=1S/C30H37NO6/c1-3-4-15-27(29(33)31-23-13-8-6-5-7-9-14-23)37-28-20-25(32)24(30(34)35)19-22(28)18-17-21-12-10-11-16-26(21)36-2/h10-12,16,19-20,23,27,32H,3-9,13-15H2,1-2H3,(H,31,33)(H,34,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087862 (CHEMBL3426911) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1ccc(CO)cc1)C(O)=O)C(=O)NC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C35H33NO6/c1-2-3-14-31(34(39)36-33(26-10-6-4-7-11-26)27-12-8-5-9-13-27)42-32-22-30(38)29(35(40)41)21-28(32)20-19-24-15-17-25(23-37)18-16-24/h4-13,15-18,21-22,31,33,37-38H,2-3,14,23H2,1H3,(H,36,39)(H,40,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087864 (CHEMBL3426909) Show SMILES CCCCC(Oc1cc(O)c(cc1C#CC1CCCC1)C(O)=O)C(=O)NC1CCCCCCC1 Show InChI InChI=1S/C28H39NO5/c1-2-3-15-25(27(31)29-22-13-7-5-4-6-8-14-22)34-26-19-24(30)23(28(32)33)18-21(26)17-16-20-11-9-10-12-20/h18-20,22,25,30H,2-15H2,1H3,(H,29,31)(H,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087867 (CHEMBL3426907) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1ccsc1)C(O)=O)C(=O)NC1CCCCCCC1 Show InChI InChI=1S/C27H33NO5S/c1-2-3-11-24(26(30)28-21-9-7-5-4-6-8-10-21)33-25-17-23(29)22(27(31)32)16-20(25)13-12-19-14-15-34-18-19/h14-18,21,24,29H,2-11H2,1H3,(H,28,30)(H,31,32)	PDB UniProtKB/SwissProt 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	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087859 (CHEMBL3426912) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1cccc(c1)C(F)(F)F)C(O)=O)C(=O)NCC1COc2ccccc2O1 Show InChI InChI=1S/C31H28F3NO7/c1-2-3-9-27(29(37)35-17-22-18-40-25-10-4-5-11-26(25)41-22)42-28-16-24(36)23(30(38)39)15-20(28)13-12-19-7-6-8-21(14-19)31(32,33)34/h4-8,10-11,14-16,22,27,36H,2-3,9,17-18H2,1H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087863 (CHEMBL3426910) Show SMILES CCCCC(Oc1cc(O)c(cc1C#Cc1ccccc1)C(O)=O)C(=O)NC1CCCCCCC1 Show InChI InChI=1S/C29H35NO5/c1-2-3-16-26(28(32)30-23-14-10-5-4-6-11-15-23)35-27-20-25(31)24(29(33)34)19-22(27)18-17-21-12-8-7-9-13-21/h7-9,12-13,19-20,23,26,31H,2-6,10-11,14-16H2,1H3,(H,30,32)(H,33,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.30E+3	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50054344 (CHEMBL3319356 | US9522881, 11a-1 L97M74 | US984453...) Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccsc2)c1 Show InChI InChI=1S/C28H20IN3O5S/c1-32-22-13-23(33)21(28(36)37)12-20(22)24(29)25(32)16-3-2-4-19(11-16)31-27(35)26(34)30-18-7-5-15(6-8-18)17-9-10-38-14-17/h2-14,33H,1H3,(H,30,34)(H,31,35)(H,36,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Inhibition of UBLCP1 (unknown origin)				J Med Chem 57: 6594-609 (2014) Article DOI: 10.1021/jm5006176 BindingDB Entry DOI: 10.7270/Q24X59FM
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50054344 (CHEMBL3319356 | US9522881, 11a-1 L97M74 | US984453...) Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccsc2)c1 Show InChI InChI=1S/C28H20IN3O5S/c1-32-22-13-23(33)21(28(36)37)12-20(22)24(29)25(32)16-3-2-4-19(11-16)31-27(35)26(34)30-18-7-5-15(6-8-18)17-9-10-38-14-17/h2-14,33H,1H3,(H,30,34)(H,31,35)(H,36,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Research and Technology Corporation US Patent					Assay Description For selectivity studies, the PTPs, including LYP, mPTPA, SHP1-D1C, PTP1B, LMPTP, VHR, Laforin and PTPα-D1D2 were expressed and purified from E. ...				US Patent US9522881 (2016) BindingDB Entry DOI: 10.7270/Q2DN4402
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM50087865 (CHEMBL3426908) Show SMILES CCCCC(Oc1cc(O)c(cc1C#CC1CCCC1)C(O)=O)C(=O)Nc1ccc2OCCOc2c1 Show InChI InChI=1S/C28H31NO7/c1-2-3-8-24(27(31)29-20-11-12-23-26(16-20)35-14-13-34-23)36-25-17-22(30)21(28(32)33)15-19(25)10-9-18-6-4-5-7-18/h11-12,15-18,24,30H,2-8,13-14H2,1H3,(H,29,31)(H,32,33)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair
Ubiquitin-like domain-containing CTD phosphatase 1 (Homo sapiens (Human))	BDBM26193 (2-Hydroxybenzoate, I | 2-hydroxybenzoic acid | CHE...) Show SMILES OC(=O)c1ccccc1O Show InChI InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	6.60E+7	n/a	n/a	n/a	n/a	6.0	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of His6-tagged UBLCP1 (unknown origin) expressed in Escherichia coli BL21 cells using pNPP as substrate at pH 6 at 25 degC by spectrophoto...				Bioorg Med Chem 23: 2798-809 (2015) Article DOI: 10.1016/j.bmc.2015.03.066 BindingDB Entry DOI: 10.7270/Q2VD7168
					More data for this Ligand-Target Pair