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Patent code US10889592

Compile Data Set for Download or QSAR
Found 39 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478041
PNG
(US10889592, Compound I-20)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1c(F)cc(cc1F)N1CC2CNCC(C1)O2
Show InChI InChI=1S/C22H24F2N6O2S/c1-11-6-28-19-18(25)20(33-22(19)29-11)21(31)27-3-2-15-16(23)4-12(5-17(15)24)30-9-13-7-26-8-14(10-30)32-13/h4-6,13-14,26H,2-3,7-10,25H2,1H3,(H,27,31)
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n/an/a<200n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478027
PNG
(US10889592, Compound I-7)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1cc(F)c(cc1F)N1CC2CCC(C1)N2
Show InChI InChI=1S/C22H24F2N6OS/c1-11-8-27-19-18(25)20(32-22(19)28-11)21(31)26-5-4-12-6-16(24)17(7-15(12)23)30-9-13-2-3-14(10-30)29-13/h6-8,13-14,29H,2-5,9-10,25H2,1H3,(H,26,31)
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n/an/a<200n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478026
PNG
(US10889592, Compound I-6)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(N2C3CCC2CNC3)c(F)c1
Show InChI InChI=1S/C22H25FN6OS/c1-12-9-27-19-18(24)20(31-22(19)28-12)21(30)26-7-6-13-2-5-17(16(23)8-13)29-14-3-4-15(29)11-25-10-14/h2,5,8-9,14-15,25H,3-4,6-7,10-11,24H2,1H3,(H,26,30)
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n/an/a<200n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478029
PNG
(US10889592, Compound I-10)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C22H25FN6OS/c1-12-9-27-19-18(24)20(31-22(19)28-12)21(30)26-7-6-13-2-3-14(8-17(13)23)29-15-4-5-16(29)11-25-10-15/h2-3,8-9,15-16,25H,4-7,10-11,24H2,1H3,(H,26,30)
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n/an/a<200n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478023
PNG
(US10889592, Compound I-3)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(N2CC3CCC(C2)N3)c(Cl)c1
Show InChI InChI=1S/C22H25ClN6OS/c1-12-9-26-19-18(24)20(31-22(19)27-12)21(30)25-7-6-13-2-5-17(16(23)8-13)29-10-14-3-4-15(11-29)28-14/h2,5,8-9,14-15,28H,3-4,6-7,10-11,24H2,1H3,(H,25,30)
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n/an/a<200n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478041
PNG
(US10889592, Compound I-20)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1c(F)cc(cc1F)N1CC2CNCC(C1)O2
Show InChI InChI=1S/C22H24F2N6O2S/c1-11-6-28-19-18(25)20(33-22(19)29-11)21(31)27-3-2-15-16(23)4-12(5-17(15)24)30-9-13-7-26-8-14(10-30)32-13/h4-6,13-14,26H,2-3,7-10,25H2,1H3,(H,27,31)
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n/an/a<200n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478026
PNG
(US10889592, Compound I-6)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(N2C3CCC2CNC3)c(F)c1
Show InChI InChI=1S/C22H25FN6OS/c1-12-9-27-19-18(24)20(31-22(19)28-12)21(30)26-7-6-13-2-5-17(16(23)8-13)29-14-3-4-15(29)11-25-10-14/h2,5,8-9,14-15,25H,3-4,6-7,10-11,24H2,1H3,(H,26,30)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478025
PNG
(US10889592, Compound I-23 | US10889592, Compound I...)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(cc1)N1C2CCC1CNC2
Show InChI InChI=1S/C22H26N6OS/c1-13-10-26-19-18(23)20(30-22(19)27-13)21(29)25-9-8-14-2-4-15(5-3-14)28-16-6-7-17(28)12-24-11-16/h2-5,10,16-17,24H,6-9,11-12,23H2,1H3,(H,25,29)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478038
PNG
(US10889592, Compound I-15)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1cc(F)c(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C23H26F2N6OS/c1-11(7-29-22(32)21-19(26)20-23(33-21)30-12(2)8-28-20)15-5-17(25)18(6-16(15)24)31-13-3-4-14(31)10-27-9-13/h5-6,8,11,13-14,27H,3-4,7,9-10,26H2,1-2H3,(H,29,32)/t11-,13?,14?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478021
PNG
(US10889592, Compound I-1)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C20H24N6OS/c1-13-12-24-17-16(21)18(28-20(17)25-13)19(27)23-7-6-14-2-4-15(5-3-14)26-10-8-22-9-11-26/h2-5,12,22H,6-11,21H2,1H3,(H,23,27)
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478042
PNG
(US10889592, Compound I-21)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1cc(F)c(cc1F)N1CC2CNCC(C1)O2
Show InChI InChI=1S/C22H24F2N6O2S/c1-11-6-28-19-18(25)20(33-22(19)29-11)21(31)27-3-2-12-4-16(24)17(5-15(12)23)30-9-13-7-26-8-14(10-30)32-13/h4-6,13-14,26H,2-3,7-10,25H2,1H3,(H,27,31)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478039
PNG
(US10889592, Compound I-16)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(cc1F)N1CC2CCC(C1)N2
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)17-6-5-16(7-18(17)24)30-10-14-3-4-15(11-30)29-14/h5-7,9,12,14-15,29H,3-4,8,10-11,25H2,1-2H3,(H,27,31)/t12-,14?,15?/m1/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478030
PNG
(US10889592, Compound I-11)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1c(F)cc(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C22H24F2N6OS/c1-11-8-28-19-18(25)20(32-22(19)29-11)21(31)27-5-4-15-16(23)6-14(7-17(15)24)30-12-2-3-13(30)10-26-9-12/h6-8,12-13,26H,2-5,9-10,25H2,1H3,(H,27,31)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478028
PNG
(US10889592, Compound I-9)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(N2C3CCC2CNC3)c(c1)C#N
Show InChI InChI=1S/C23H25N7OS/c1-13-10-28-20-19(25)21(32-23(20)29-13)22(31)27-7-6-14-2-5-18(15(8-14)9-24)30-16-3-4-17(30)12-26-11-16/h2,5,8,10,16-17,26H,3-4,6-7,11-12,25H2,1H3,(H,27,31)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478045
PNG
(US10889592, Compound I-17)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(cc1F)N1CC2CCC(C1)N2
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)17-6-5-16(7-18(17)24)30-10-14-3-4-15(11-30)29-14/h5-7,9,12,14-15,29H,3-4,8,10-11,25H2,1-2H3,(H,27,31)/t12-,14?,15?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478039
PNG
(US10889592, Compound I-16)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(cc1F)N1CC2CCC(C1)N2
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)17-6-5-16(7-18(17)24)30-10-14-3-4-15(11-30)29-14/h5-7,9,12,14-15,29H,3-4,8,10-11,25H2,1-2H3,(H,27,31)/t12-,14?,15?/m1/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478043
PNG
(US10889592, Compound I-22)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1cc(F)c(cc1F)N1CC2CNCC(C1)O2
Show InChI InChI=1S/C23H26F2N6O2S/c1-11(5-29-22(32)21-19(26)20-23(34-21)30-12(2)6-28-20)15-3-17(25)18(4-16(15)24)31-9-13-7-27-8-14(10-31)33-13/h3-4,6,11,13-14,27H,5,7-10,26H2,1-2H3,(H,29,32)/t11-,13?,14?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478030
PNG
(US10889592, Compound I-11)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1c(F)cc(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C22H24F2N6OS/c1-11-8-28-19-18(25)20(32-22(19)29-11)21(31)27-5-4-15-16(23)6-14(7-17(15)24)30-12-2-3-13(30)10-26-9-12/h6-8,12-13,26H,2-5,9-10,25H2,1H3,(H,27,31)
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478043
PNG
(US10889592, Compound I-22)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1cc(F)c(cc1F)N1CC2CNCC(C1)O2
Show InChI InChI=1S/C23H26F2N6O2S/c1-11(5-29-22(32)21-19(26)20-23(34-21)30-12(2)6-28-20)15-3-17(25)18(4-16(15)24)31-9-13-7-27-8-14(10-31)33-13/h3-4,6,11,13-14,27H,5,7-10,26H2,1-2H3,(H,29,32)/t11-,13?,14?/m0/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478029
PNG
(US10889592, Compound I-10)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C22H25FN6OS/c1-12-9-27-19-18(24)20(31-22(19)28-12)21(30)26-7-6-13-2-3-14(8-17(13)23)29-15-4-5-16(29)11-25-10-15/h2-3,8-9,15-16,25H,4-7,10-11,24H2,1H3,(H,26,30)
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478027
PNG
(US10889592, Compound I-7)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1cc(F)c(cc1F)N1CC2CCC(C1)N2
Show InChI InChI=1S/C22H24F2N6OS/c1-11-8-27-19-18(25)20(32-22(19)28-11)21(31)26-5-4-12-6-16(24)17(7-15(12)23)30-9-13-2-3-14(10-30)29-13/h6-8,13-14,29H,2-5,9-10,25H2,1H3,(H,26,31)
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM50279692
PNG
(CHEMBL4159041 | US10889592, Compound I-4)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1cc(F)c(cc1F)N1CCNCC1
Show InChI InChI=1S/C20H22F2N6OS/c1-11-10-26-17-16(23)18(30-20(17)27-11)19(29)25-3-2-12-8-14(22)15(9-13(12)21)28-6-4-24-5-7-28/h8-10,24H,2-7,23H2,1H3,(H,25,29)
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478031
PNG
(BDBM50279688 | US10889592, Compound I-12)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(F)c1
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)14-3-6-18(17(24)7-14)30-10-15-4-5-16(11-30)29-15/h3,6-7,9,12,15-16,29H,4-5,8,10-11,25H2,1-2H3,(H,27,31)/t12-,15?,16?/m1/s1
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n/an/a 1.10E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478042
PNG
(US10889592, Compound I-21)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1cc(F)c(cc1F)N1CC2CNCC(C1)O2
Show InChI InChI=1S/C22H24F2N6O2S/c1-11-6-28-19-18(25)20(33-22(19)29-11)21(31)27-3-2-12-4-16(24)17(5-15(12)23)30-9-13-7-26-8-14(10-30)32-13/h4-6,13-14,26H,2-3,7-10,25H2,1H3,(H,27,31)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM50279691
PNG
(CHEMBL4160957 | US10889592, Compound I-13)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(F)c1
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)14-3-6-18(17(24)7-14)30-10-15-4-5-16(11-30)29-15/h3,6-7,9,12,15-16,29H,4-5,8,10-11,25H2,1-2H3,(H,27,31)/t12-,15?,16?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478028
PNG
(US10889592, Compound I-9)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(N2C3CCC2CNC3)c(c1)C#N
Show InChI InChI=1S/C23H25N7OS/c1-13-10-28-20-19(25)21(32-23(20)29-13)22(31)27-7-6-14-2-5-18(15(8-14)9-24)30-16-3-4-17(30)12-26-11-16/h2,5,8,10,16-17,26H,3-4,6-7,11-12,25H2,1H3,(H,27,31)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478022
PNG
(US10889592, Compound I-2)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(N2CCNCC2)c(Cl)c1
Show InChI InChI=1S/C20H23ClN6OS/c1-12-11-25-17-16(22)18(29-20(17)26-12)19(28)24-5-4-13-2-3-15(14(21)10-13)27-8-6-23-7-9-27/h2-3,10-11,23H,4-9,22H2,1H3,(H,24,28)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478025
PNG
(US10889592, Compound I-23 | US10889592, Compound I...)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(cc1)N1C2CCC1CNC2
Show InChI InChI=1S/C22H26N6OS/c1-13-10-26-19-18(23)20(30-22(19)27-13)21(29)25-9-8-14-2-4-15(5-3-14)28-16-6-7-17(28)12-24-11-16/h2-5,10,16-17,24H,6-9,11-12,23H2,1H3,(H,25,29)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478025
PNG
(US10889592, Compound I-23 | US10889592, Compound I...)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1ccc(cc1)N1C2CCC1CNC2
Show InChI InChI=1S/C22H26N6OS/c1-13-10-26-19-18(23)20(30-22(19)27-13)21(29)25-9-8-14-2-4-15(5-3-14)28-16-6-7-17(28)12-24-11-16/h2-5,10,16-17,24H,6-9,11-12,23H2,1H3,(H,25,29)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478045
PNG
(US10889592, Compound I-17)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(cc1F)N1CC2CCC(C1)N2
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)17-6-5-16(7-18(17)24)30-10-14-3-4-15(11-30)29-14/h5-7,9,12,14-15,29H,3-4,8,10-11,25H2,1-2H3,(H,27,31)/t12-,14?,15?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478040
PNG
(US10889592, Compound I-18)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(c1)C#N
Show InChI InChI=1S/C24H27N7OS/c1-13(9-28-23(32)22-20(26)21-24(33-22)29-14(2)10-27-21)15-3-6-19(16(7-15)8-25)31-11-17-4-5-18(12-31)30-17/h3,6-7,10,13,17-18,30H,4-5,9,11-12,26H2,1-2H3,(H,28,32)/t13-,17?,18?/m1/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM50279691
PNG
(CHEMBL4160957 | US10889592, Compound I-13)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(F)c1
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)14-3-6-18(17(24)7-14)30-10-15-4-5-16(11-30)29-15/h3,6-7,9,12,15-16,29H,4-5,8,10-11,25H2,1-2H3,(H,27,31)/t12-,15?,16?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478046
PNG
(US10889592, Compound I-19)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(c1)C#N
Show InChI InChI=1S/C24H27N7OS/c1-13(9-28-23(32)22-20(26)21-24(33-22)29-14(2)10-27-21)15-3-6-19(16(7-15)8-25)31-11-17-4-5-18(12-31)30-17/h3,6-7,10,13,17-18,30H,4-5,9,11-12,26H2,1-2H3,(H,28,32)/t13-,17?,18?/m0/s1
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n/an/a 6.00E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478034
PNG
(US10889592, Compound I-14)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1cc(F)c(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C23H26F2N6OS/c1-11(7-29-22(32)21-19(26)20-23(33-21)30-12(2)8-28-20)15-5-17(25)18(6-16(15)24)31-13-3-4-14(31)10-27-9-13/h5-6,8,11,13-14,27H,3-4,7,9-10,26H2,1-2H3,(H,29,32)/t11-,13?,14?/m1/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478031
PNG
(BDBM50279688 | US10889592, Compound I-12)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(F)c1
Show InChI InChI=1S/C23H27FN6OS/c1-12(8-27-22(31)21-19(25)20-23(32-21)28-13(2)9-26-20)14-3-6-18(17(24)7-14)30-10-15-4-5-16(11-30)29-15/h3,6-7,9,12,15-16,29H,4-5,8,10-11,25H2,1-2H3,(H,27,31)/t12-,15?,16?/m1/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478038
PNG
(US10889592, Compound I-15)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1cc(F)c(cc1F)N1C2CCC1CNC2
Show InChI InChI=1S/C23H26F2N6OS/c1-11(7-29-22(32)21-19(26)20-23(33-21)30-12(2)8-28-20)15-5-17(25)18(6-16(15)24)31-13-3-4-14(31)10-27-9-13/h5-6,8,11,13-14,27H,3-4,7,9-10,26H2,1-2H3,(H,29,32)/t11-,13?,14?/m0/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM50279692
PNG
(CHEMBL4159041 | US10889592, Compound I-4)
Show SMILES Cc1cnc2c(N)c(sc2n1)C(=O)NCCc1cc(F)c(cc1F)N1CCNCC1
Show InChI InChI=1S/C20H22F2N6OS/c1-11-10-26-17-16(23)18(30-20(17)27-11)19(29)25-3-2-12-8-14(22)15(9-13(12)21)28-6-4-24-5-7-28/h8-10,24H,2-7,23H2,1H3,(H,25,29)
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 25


(Homo sapiens)
BDBM478040
PNG
(US10889592, Compound I-18)
Show SMILES C[C@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(c1)C#N
Show InChI InChI=1S/C24H27N7OS/c1-13(9-28-23(32)22-20(26)21-24(33-22)29-14(2)10-27-21)15-3-6-19(16(7-15)8-25)31-11-17-4-5-18(12-31)30-17/h3,6-7,10,13,17-18,30H,4-5,9,11-12,26H2,1-2H3,(H,28,32)/t13-,17?,18?/m1/s1
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VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP25: The assay was performed in a final volume of 9 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Corni...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 28


(Homo sapiens)
BDBM478046
PNG
(US10889592, Compound I-19)
Show SMILES C[C@@H](CNC(=O)c1sc2nc(C)cnc2c1N)c1ccc(N2CC3CCC(C2)N3)c(c1)C#N
Show InChI InChI=1S/C24H27N7OS/c1-13(9-28-23(32)22-20(26)21-24(33-22)29-14(2)10-27-21)15-3-6-19(16(7-15)8-25)31-11-17-4-5-18(12-31)30-17/h3,6-7,10,13,17-18,30H,4-5,9,11-12,26H2,1-2H3,(H,28,32)/t13-,17?,18?/m0/s1
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PC cid
PC sid
UniChem
US Patent
n/an/a 6.00E+3n/an/an/an/an/an/a



VALO EARLY DISCOVERY, INC.

US Patent


Assay Description
USP28: Each assay was performed in a final volume of 20 μL in assay buffer containing 20 mM Tris-HCl (pH 8.0, (1M Tris-HCl, pH 8.0 solution; Cor...


US Patent US10889592 (2021)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%