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Found 154 hits Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50469035
PNG
(CHEMBL4282693)
Show SMILES Fc1cccc(F)c1CNC(=O)c1sccc1OCc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C19H13Cl2F2NO2S/c20-12-5-4-11(14(21)8-12)10-26-17-6-7-27-18(17)19(25)24-9-13-15(22)2-1-3-16(13)23/h1-8H,9-10H2,(H,24,25)
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440n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SHIP2 (419 to 732 residues) expressed in Escherichia coli by malachite green phosphate assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50430584
PNG
(CHEMBL2337806)
Show SMILES C[C@H](NC(=O)c1sccc1OCc1ccc(Cl)cc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H18ClNO2S/c1-14(16-5-3-2-4-6-16)22-20(23)19-18(11-12-25-19)24-13-15-7-9-17(21)10-8-15/h2-12,14H,13H2,1H3,(H,22,23)/t14-/m0/s1
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440n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SHIP2 (419 to 732 residues) expressed in Escherichia coli by malachite green phosphate assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(RAT)
BDBM50022784
PNG
((R)-N-methyl-3-phenyl-3-(o-tolyloxy)propan-1-amine...)
Show SMILES CNCCC(Oc1ccccc1C)c1ccccc1
Show InChI InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 27: 699-711 (2002)


Article DOI: 10.1016/S0893-133X(02)00346-9
BindingDB Entry DOI: 10.7270/Q2GQ6W98
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(RAT)
BDBM84745
PNG
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)
Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1 |r|
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 25: 871-80 (2001)


Article DOI: 10.1016/S0893-133X(01)00298-6
BindingDB Entry DOI: 10.7270/Q25M648W
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(RAT)
BDBM82071
PNG
(CAS_93413-69-5 | CAS_99300-78-4 | NSC_62923 | VENL...)
Show SMILES COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
Show InChI InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 25: 871-80 (2001)


Article DOI: 10.1016/S0893-133X(01)00298-6
BindingDB Entry DOI: 10.7270/Q25M648W
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586357
PNG
(CHEMBL5080660)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OCCOc1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OP(O)(O)=O
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4.90E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SHIP2 (419 to 732 residues) expressed in Escherichia coli by malachite green phosphate assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(RAT)
BDBM50010685
PNG
((+/-)-trans-10,11-dihydroxy-5,6,6a,7,8,12b-hexahyd...)
Show SMILES Oc1cc2CC[C@H]3NCc4ccccc4[C@H]3c2cc1O
Show InChI InChI=1S/C17H17NO2/c19-15-7-10-5-6-14-17(13(10)8-16(15)20)12-4-2-1-3-11(12)9-18-14/h1-4,7-8,14,17-20H,5-6,9H2/t14-,17+/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of North Carolina

Curated by PDSP Ki Database




J Pharmacol Exp Ther 262: 383-93 (1992)


BindingDB Entry DOI: 10.7270/Q218350W
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586355
PNG
(CHEMBL5087243)
Show SMILES OP(O)(=O)Oc1cc(cc(OP(O)(O)=O)c1OP(O)(O)=O)-c1cc(OP(O)(O)=O)c(OP(O)(O)=O)c(OP(O)(O)=O)c1
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n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 2-FAM-InsP5 binding to human SHIP2 catalytic domain (419 to 832 residues) assessed as change in polarization by fluorescence polarizati...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586354
PNG
(CHEMBL5078323)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(cc1OP(O)(O)=O)-c1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OP(O)(O)=O
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n/an/a 27n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 2-FAM-InsP5 binding to human SHIP2 catalytic domain (419 to 832 residues) assessed as change in polarization by fluorescence polarizati...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586353
PNG
(CHEMBL5092991)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(c(OP(O)(O)=O)c1)-c1cc(OP(O)(O)=O)cc(OP(O)(O)=O)c1
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n/an/a 29n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 2-FAM-InsP5 binding to human SHIP2 catalytic domain (419 to 832 residues) assessed as change in polarization by fluorescence polarizati...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586357
PNG
(CHEMBL5080660)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OCCOc1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OP(O)(O)=O
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n/an/a 31n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 2-FAM-InsP5 binding to human SHIP2 catalytic domain (419 to 832 residues) assessed as change in polarization by fluorescence polarizati...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586356
PNG
(CHEMBL5081948)
Show SMILES OP(O)(=O)Oc1cc(F)c(cc1OP(O)(O)=O)-c1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1F
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n/an/a 61n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of 2-FAM-InsP5 binding to human SHIP2 catalytic domain (419 to 832 residues) assessed as change in polarization by fluorescence polarizati...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054344
PNG
(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)
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n/an/a 200n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054344
PNG
(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)
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n/an/a 200n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054344
PNG
(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)
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n/an/a 200n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054344
PNG
(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)
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n/an/a 200n/an/an/an/an/an/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
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054344
PNG
(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)
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n/an/a 200n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054257
PNG
(CHEMBL3319376 | US9522881, 11a-21 L97L08 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C31H21IN4O5/c1-36-25-15-26(37)24(31(40)41)14-23(25)27(32)28(36)20-3-2-4-22(13-20)35-30(39)29(38)34-21-11-9-19(10-12-21)18-7-5-17(16-33)6-8-18/h2-15,37H,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 220n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054257
PNG
(CHEMBL3319376 | US9522881, 11a-21 L97L08 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C31H21IN4O5/c1-36-25-15-26(37)24(31(40)41)14-23(25)27(32)28(36)20-3-2-4-22(13-20)35-30(39)29(38)34-21-11-9-19(10-12-21)18-7-5-17(16-33)6-8-18/h2-15,37H,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 220n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054258
PNG
(CHEMBL3319377 | US9522881, 11a-22 L97L07 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2cccc(c2)C#N)c1
Show InChI InChI=1S/C31H21IN4O5/c1-36-25-15-26(37)24(31(40)41)14-23(25)27(32)28(36)20-6-3-7-22(13-20)35-30(39)29(38)34-21-10-8-18(9-11-21)19-5-2-4-17(12-19)16-33/h2-15,37H,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 310n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054258
PNG
(CHEMBL3319377 | US9522881, 11a-22 L97L07 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2cccc(c2)C#N)c1
Show InChI InChI=1S/C31H21IN4O5/c1-36-25-15-26(37)24(31(40)41)14-23(25)27(32)28(36)20-6-3-7-22(13-20)35-30(39)29(38)34-21-10-8-18(9-11-21)19-5-2-4-17(12-19)16-33/h2-15,37H,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 310n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054259
PNG
(CHEMBL3319378 | US9522881, 11a-23 L97L03)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccccc2-c2ccc(CO)o2)c1
Show InChI InChI=1S/C29H22IN3O7/c1-33-22-13-23(35)20(29(38)39)12-19(22)25(30)26(33)15-5-4-6-16(11-15)31-27(36)28(37)32-21-8-3-2-7-18(21)24-10-9-17(14-34)40-24/h2-13,34-35H,14H2,1H3,(H,31,36)(H,32,37)(H,38,39)
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n/an/a 370n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM362880
PNG
(US9844535, ID 11a-23 L97L03)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccccc2-c2ccc(CCO)o2)c1
Show InChI InChI=1S/C30H24IN3O7/c1-34-23-15-24(36)21(30(39)40)14-20(23)26(31)27(34)16-5-4-6-17(13-16)32-28(37)29(38)33-22-8-3-2-7-19(22)25-10-9-18(41-25)11-12-35/h2-10,13-15,35-36H,11-12H2,1H3,(H,32,37)(H,33,38)(H,39,40)
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n/an/a 370n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054260
PNG
(CHEMBL3319379 | US9522881, 11a-24 L97L05 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccco2)c1
Show InChI InChI=1S/C28H20IN3O6/c1-32-21-14-22(33)20(28(36)37)13-19(21)24(29)25(32)16-6-3-8-18(12-16)31-27(35)26(34)30-17-7-2-5-15(11-17)23-9-4-10-38-23/h2-14,33H,1H3,(H,30,34)(H,31,35)(H,36,37)
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n/an/a 380n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054260
PNG
(CHEMBL3319379 | US9522881, 11a-24 L97L05 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccco2)c1
Show InChI InChI=1S/C28H20IN3O6/c1-32-21-14-22(33)20(28(36)37)13-19(21)24(29)25(32)16-6-3-8-18(12-16)31-27(35)26(34)30-17-7-2-5-15(11-17)23-9-4-10-38-23/h2-14,33H,1H3,(H,30,34)(H,31,35)(H,36,37)
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n/an/a 380n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Mus musculus)
BDBM50511342
PNG
(CHEMBL4538474)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OP(O)(O)=O
Show InChI InChI=1S/C6H10O16P4/c7-23(8,9)19-3-1-4(20-24(10,11)12)6(22-26(16,17)18)2-5(3)21-25(13,14)15/h1-2H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)
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n/an/a 390n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of SHIP2 in serum-starved mouse Mm1 cells assessed as reduction in Akt phosphorylation incubated for 30 mins by Western blot analysis


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054261
PNG
(CHEMBL3319380 | US9522881, 11a-25 L97L06 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C31H21IN4O5/c1-36-25-15-26(37)24(31(40)41)14-23(25)27(32)28(36)20-5-3-7-22(13-20)35-30(39)29(38)34-21-6-2-4-19(12-21)18-10-8-17(16-33)9-11-18/h2-15,37H,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 420n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054261
PNG
(CHEMBL3319380 | US9522881, 11a-25 L97L06 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C31H21IN4O5/c1-36-25-15-26(37)24(31(40)41)14-23(25)27(32)28(36)20-5-3-7-22(13-20)35-30(39)29(38)34-21-6-2-4-19(12-21)18-10-8-17(16-33)9-11-18/h2-15,37H,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 420n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054406
PNG
(CHEMBL3319357 | US9522881, 11a-2 (L97N08) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccccc2)c1
Show InChI InChI=1S/C30H22IN3O5/c1-34-24-16-25(35)23(30(38)39)15-22(24)26(31)27(34)19-8-5-9-21(14-19)33-29(37)28(36)32-20-12-10-18(11-13-20)17-6-3-2-4-7-17/h2-16,35H,1H3,(H,32,36)(H,33,37)(H,38,39)
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n/an/a 620n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50430584
PNG
(CHEMBL2337806)
Show SMILES C[C@H](NC(=O)c1sccc1OCc1ccc(Cl)cc1)c1ccccc1 |r|
Show InChI InChI=1S/C20H18ClNO2S/c1-14(16-5-3-2-4-6-16)22-20(23)19-18(11-12-25-19)24-13-15-7-9-17(21)10-8-15/h2-12,14H,13H2,1H3,(H,22,23)/t14-/m0/s1
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n/an/a 620n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of SHIP2 (unknown origin)


Eur J Med Chem 62: 649-60 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.014
BindingDB Entry DOI: 10.7270/Q2D79CS1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054406
PNG
(CHEMBL3319357 | US9522881, 11a-2 (L97N08) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccccc2)c1
Show InChI InChI=1S/C30H22IN3O5/c1-34-24-16-25(35)23(30(38)39)15-22(24)26(31)27(34)19-8-5-9-21(14-19)33-29(37)28(36)32-20-12-10-18(11-13-20)17-6-3-2-4-7-17/h2-16,35H,1H3,(H,32,36)(H,33,37)(H,38,39)
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n/an/a 620n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054262
PNG
(CHEMBL3319381 | US9522881, 11a-26 L97L02 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccsc2)c1
Show InChI InChI=1S/C28H20IN3O5S/c1-32-22-13-23(33)21(28(36)37)12-20(22)24(29)25(32)16-5-3-7-19(11-16)31-27(35)26(34)30-18-6-2-4-15(10-18)17-8-9-38-14-17/h2-14,33H,1H3,(H,30,34)(H,31,35)(H,36,37)
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n/an/a 630n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054262
PNG
(CHEMBL3319381 | US9522881, 11a-26 L97L02 | US98445...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccsc2)c1
Show InChI InChI=1S/C28H20IN3O5S/c1-32-22-13-23(33)21(28(36)37)12-20(22)24(29)25(32)16-5-3-7-19(11-16)31-27(35)26(34)30-18-6-2-4-15(10-18)17-8-9-38-14-17/h2-14,33H,1H3,(H,30,34)(H,31,35)(H,36,37)
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n/an/a 630n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054405
PNG
(CHEMBL3319358 | US9522881, 11a-3 (L97M50) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(OCc3ccccc3)c(Cl)c2)c1
Show InChI InChI=1S/C31H23ClIN3O6/c1-36-24-15-25(37)22(31(40)41)14-21(24)27(33)28(36)18-8-5-9-19(12-18)34-29(38)30(39)35-20-10-11-26(23(32)13-20)42-16-17-6-3-2-4-7-17/h2-15,37H,16H2,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 660n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054405
PNG
(CHEMBL3319358 | US9522881, 11a-3 (L97M50) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(OCc3ccccc3)c(Cl)c2)c1
Show InChI InChI=1S/C31H23ClIN3O6/c1-36-24-15-25(37)22(31(40)41)14-21(24)27(33)28(36)18-8-5-9-19(12-18)34-29(38)30(39)35-20-10-11-26(23(32)13-20)42-16-17-6-3-2-4-7-17/h2-15,37H,16H2,1H3,(H,34,38)(H,35,39)(H,40,41)
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n/an/a 660n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586355
PNG
(CHEMBL5087243)
Show SMILES OP(O)(=O)Oc1cc(cc(OP(O)(O)=O)c1OP(O)(O)=O)-c1cc(OP(O)(O)=O)c(OP(O)(O)=O)c(OP(O)(O)=O)c1
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n/an/a 700n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SHIP2 catalytic domain (419 to 832 residues) phosphatase activity assessed as inhibition of Ins(1,3,4,5)P4 production using Ins(1...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054404
PNG
(CHEMBL3319359 | US9522881, 11a-4 (L97M61) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2nc3ccc(Br)cc3s2)c1
Show InChI InChI=1S/C25H16BrIN4O5S/c1-31-17-10-18(32)15(24(35)36)9-14(17)20(27)21(31)11-3-2-4-13(7-11)28-22(33)23(34)30-25-29-16-6-5-12(26)8-19(16)37-25/h2-10,32H,1H3,(H,28,33)(H,35,36)(H,29,30,34)
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n/an/a 760n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054404
PNG
(CHEMBL3319359 | US9522881, 11a-4 (L97M61) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2nc3ccc(Br)cc3s2)c1
Show InChI InChI=1S/C25H16BrIN4O5S/c1-31-17-10-18(32)15(24(35)36)9-14(17)20(27)21(31)11-3-2-4-13(7-11)28-22(33)23(34)30-25-29-16-6-5-12(26)8-19(16)37-25/h2-10,32H,1H3,(H,28,33)(H,35,36)(H,29,30,34)
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n/an/a 760n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054403
PNG
(CHEMBL3319360 | US9522881, 11a-5 (L97M48) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccccc2)c1
Show InChI InChI=1S/C30H22IN3O5/c1-34-24-16-25(35)23(30(38)39)15-22(24)26(31)27(34)19-10-6-12-21(14-19)33-29(37)28(36)32-20-11-5-9-18(13-20)17-7-3-2-4-8-17/h2-16,35H,1H3,(H,32,36)(H,33,37)(H,38,39)
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n/an/a 770n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054403
PNG
(CHEMBL3319360 | US9522881, 11a-5 (L97M48) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(c2)-c2ccccc2)c1
Show InChI InChI=1S/C30H22IN3O5/c1-34-24-16-25(35)23(30(38)39)15-22(24)26(31)27(34)19-10-6-12-21(14-19)33-29(37)28(36)32-20-11-5-9-18(13-20)17-7-3-2-4-8-17/h2-16,35H,1H3,(H,32,36)(H,33,37)(H,38,39)
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n/an/a 770n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054402
PNG
(CHEMBL3319361 | US9522881, 11a-6 (L97M52) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(OCc3ccccc3)c2)c1
Show InChI InChI=1S/C31H24IN3O6/c1-35-25-16-26(36)24(31(39)40)15-23(25)27(32)28(35)19-9-5-10-20(13-19)33-29(37)30(38)34-21-11-6-12-22(14-21)41-17-18-7-3-2-4-8-18/h2-16,36H,17H2,1H3,(H,33,37)(H,34,38)(H,39,40)
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n/an/a 860n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054402
PNG
(CHEMBL3319361 | US9522881, 11a-6 (L97M52) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2cccc(OCc3ccccc3)c2)c1
Show InChI InChI=1S/C31H24IN3O6/c1-35-25-16-26(36)24(31(39)40)15-23(25)27(32)28(35)19-9-5-10-20(13-19)33-29(37)30(38)34-21-11-6-12-22(14-21)41-17-18-7-3-2-4-8-18/h2-16,36H,17H2,1H3,(H,33,37)(H,34,38)(H,39,40)
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n/an/a 860n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586354
PNG
(CHEMBL5078323)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(cc1OP(O)(O)=O)-c1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OP(O)(O)=O
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n/an/a 900n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SHIP2 catalytic domain (419 to 832 residues) phosphatase activity assessed as inhibition of Ins(1,3,4,5)P4 production using Ins(1...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50586355
PNG
(CHEMBL5087243)
Show SMILES OP(O)(=O)Oc1cc(cc(OP(O)(O)=O)c1OP(O)(O)=O)-c1cc(OP(O)(O)=O)c(OP(O)(O)=O)c(OP(O)(O)=O)c1
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n/an/a 1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human SHIP2 catalytic domain (419 to 832 residues) phosphatase activity assessed as phosphate release using Ins(1,3,4,5)P4 as substrate...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01944
BindingDB Entry DOI: 10.7270/Q2V98CZM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50511346
PNG
(CHEMBL4454154)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(OP(O)(O)=O)c(OP(O)(O)=O)c1
Show InChI InChI=1S/C6H10O16P4/c7-23(8,9)19-3-1-4(20-24(10,11)12)6(22-26(16,17)18)5(2-3)21-25(13,14)15/h1-2H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)
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n/an/a 1.01E+3n/an/an/an/an/an/a



School of Biological Sciences, UEA

Curated by ChEMBL


Assay Description
Displacement of 2FAMInsP5 from recombinant human N-terminal His-tagged SHIP2 (419 to 832 residues) expressed in Escherichia coli Rosetta2 (DE3) cells...


ACS Med Chem Lett 11: 309-315 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00368
BindingDB Entry DOI: 10.7270/Q2BP063F
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50511342
PNG
(CHEMBL4538474)
Show SMILES OP(O)(=O)Oc1cc(OP(O)(O)=O)c(OP(O)(O)=O)cc1OP(O)(O)=O
Show InChI InChI=1S/C6H10O16P4/c7-23(8,9)19-3-1-4(20-24(10,11)12)6(22-26(16,17)18)2-5(3)21-25(13,14)15/h1-2H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)
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n/an/a 1.02E+3n/an/an/an/an/an/a



School of Biological Sciences, UEA

Curated by ChEMBL


Assay Description
Displacement of 2FAMInsP5 from recombinant human N-terminal His-tagged SHIP2 (419 to 832 residues) expressed in Escherichia coli Rosetta2 (DE3) cells...


ACS Med Chem Lett 11: 309-315 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00368
BindingDB Entry DOI: 10.7270/Q2BP063F
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054401
PNG
(CHEMBL3319362 | US9522881, 11a-7 (L97M93) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)N2CCc3cc(Br)ccc23)c1
Show InChI InChI=1S/C26H19BrIN3O5/c1-30-20-12-21(32)18(26(35)36)11-17(20)22(28)23(30)14-3-2-4-16(10-14)29-24(33)25(34)31-8-7-13-9-15(27)5-6-19(13)31/h2-6,9-12,32H,7-8H2,1H3,(H,29,33)(H,35,36)
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n/an/a 1.05E+3n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054401
PNG
(CHEMBL3319362 | US9522881, 11a-7 (L97M93) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)N2CCc3cc(Br)ccc23)c1
Show InChI InChI=1S/C26H19BrIN3O5/c1-30-20-12-21(32)18(26(35)36)11-17(20)22(28)23(30)14-3-2-4-16(10-14)29-24(33)25(34)31-8-7-13-9-15(27)5-6-19(13)31/h2-6,9-12,32H,7-8H2,1H3,(H,29,33)(H,35,36)
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n/an/a 1.05E+3n/an/an/an/a7.0n/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
The inhibition assays were performed at 25° C. in 50 mM 3,3-dimethylglutarate buffer, pH 7.0, containing 1 mM EDTA with an ionic strength of 0.15M ad...


US Patent US9522881 (2016)


BindingDB Entry DOI: 10.7270/Q2DN4402
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50430583
PNG
(CHEMBL2337807)
Show SMILES CC(C)N(CCNc1ccc(cn1)-c1cc(-c2ccc(F)cc2)n(n1)-c1ccc(Cl)c(Cl)c1)C(C)C
Show InChI InChI=1S/C28H30Cl2FN5/c1-18(2)35(19(3)4)14-13-32-28-12-7-21(17-33-28)26-16-27(20-5-8-22(31)9-6-20)36(34-26)23-10-11-24(29)25(30)15-23/h5-12,15-19H,13-14H2,1-4H3,(H,32,33)
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of SHIP2 (unknown origin)


Eur J Med Chem 62: 649-60 (2013)


Article DOI: 10.1016/j.ejmech.2013.01.014
BindingDB Entry DOI: 10.7270/Q2D79CS1
More data for this
Ligand-Target Pair
Phosphatidylinositol 3,4,5-trisphosphate 5-phosphatase 2


(Homo sapiens (Human))
BDBM50054400
PNG
(CHEMBL3319363 | US9522881, 11a-8 (L97M24) | US9844...)
Show SMILES Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(I)cc2)c1
Show InChI InChI=1S/C24H17I2N3O5/c1-29-18-11-19(30)17(24(33)34)10-16(18)20(26)21(29)12-3-2-4-15(9-12)28-23(32)22(31)27-14-7-5-13(25)6-8-14/h2-11,30H,1H3,(H,27,31)(H,28,32)(H,33,34)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Indiana University Research and Technology Corporation

US Patent


Assay Description
PTP assays were conducted as previously described in Kontaridis et al., J Biol Chem. 2006; 281:6785-6792, using para-nitrophenyl phosphate (pNPP, obt...


US Patent US9844535 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89X1
More data for this
Ligand-Target Pair
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