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Patent code US10561655

Compile Data Set for Download or QSAR
Found 27 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/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433292
PNG
(6-amino-2-(3- (aminomethyl)-3- methylpyrrolidin-1-...)
Show SMILES Cn1c(nc(N)c(Sc2cccc(Cl)c2Cl)c1=O)N1CCC(C)(CN)C1
Show InChI InChI=1S/C17H21Cl2N5OS/c1-17(8-20)6-7-24(9-17)16-22-14(21)13(15(25)23(16)2)26-11-5-3-4-10(18)12(11)19/h3-5H,6-9,20-21H2,1-2H3
PDB
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n/an/a<50n/an/an/an/an/an/a



SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433311
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3cccc(F)c3F)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433296
PNG
(N-(3-((5-(4- (aminomethyl)-4- methylpiperidin-1-yl...)
Show SMILES CC1(CN)CCN(CC1)c1ncc(Sc2cccc(NC(=O)c3c(O)nc4ccccn4c3=O)c2Cl)[nH]c1=O
Show InChI InChI=1S/C26H26ClN7O4S/c1-26(14-28)8-11-33(12-9-26)21-24(37)32-18(13-29-21)39-16-6-4-5-15(20(16)27)30-22(35)19-23(36)31-17-7-2-3-10-34(17)25(19)38/h2-7,10,13,36H,8-9,11-12,14,28H2,1H3,(H,30,35)(H,32,37)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433305
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES COc1cccc(Sc2cnc(N3CCC4(CO[C@@H](C)[C@H]4N)CC3)c(=O)[nH]2)c1Cl
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433310
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3cccc(F)c3Cl)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433316
PNG
((R)-3-(3-amino-3H- spiro[benzofuran-2,4'- piperidi...)
Show SMILES N[C@@H]1c2ccccc2OC11CCN(CC1)c1ncc(Sc2cccc(Cl)c2Cl)[nH]c1=O
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433290
PNG
(3-(4-(aminomethyl)-4- methylpiperidin-1-yl)-6- ((2...)
Show SMILES CC1(CN)CCN(CC1)c1ncc(Sc2cccc(Cl)c2Cl)[nH]c1=O
Show InChI InChI=1S/C17H20Cl2N4OS/c1-17(10-20)5-7-23(8-6-17)15-16(24)22-13(9-21-15)25-12-4-2-3-11(18)14(12)19/h2-4,9H,5-8,10,20H2,1H3,(H,22,24)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433308
PNG
(4-((5-(4-(aminomethyl)-4- methylpiperidin-1-yl)-6-...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3ccnc(F)c3F)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433298
PNG
(N-(3-((5-(4- (aminomethyl)-4- methylpiperidin-1-yl...)
Show SMILES CN1C(=O)C(C(=O)Nc2cccc(Sc3cnc(N4CCC(C)(CN)CC4)c(=O)[nH]3)c2Cl)=C(Cl)C1(C)C
Show InChI InChI=1S/C25H30Cl2N6O3S/c1-24(2)19(27)17(23(36)32(24)4)21(34)30-14-6-5-7-15(18(14)26)37-16-12-29-20(22(35)31-16)33-10-8-25(3,13-28)9-11-33/h5-7,12H,8-11,13,28H2,1-4H3,(H,30,34)(H,31,35)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433312
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3ccnc(F)c3Cl)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433293
PNG
(6-(4-(aminomethyl)-4- methylpiperidin-1-yl)-3- ((2...)
Show SMILES CC1(CN)CCN(CC1)c1nc2[nH]nc(Nc3cccc(Cl)c3Cl)c2c(=O)[nH]1
Show InChI InChI=1S/C18H21Cl2N7O/c1-18(9-21)5-7-27(8-6-18)17-23-15-12(16(28)24-17)14(25-26-15)22-11-4-2-3-10(19)13(11)20/h2-4H,5-9,21H2,1H3,(H3,22,23,24,25,26,28)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433301
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3cccc(Cl)c3Cl)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433297
PNG
(N-(3-((5-(4- (aminomethyl)-4- methylpiperidin-1-yl...)
Show SMILES CC1(CN)CCN(CC1)c1ncc(Sc2cccc(NC(=O)c3c(O)nc4[nH]ccn4c3=O)c2Cl)[nH]c1=O
Show InChI InChI=1S/C24H25ClN8O4S/c1-24(12-26)5-8-32(9-6-24)18-21(36)30-15(11-28-18)38-14-4-2-3-13(17(14)25)29-19(34)16-20(35)31-23-27-7-10-33(23)22(16)37/h2-4,7,10-11,35H,5-6,8-9,12,26H2,1H3,(H,27,31)(H,29,34)(H,30,36)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433303
PNG
(1-(3-aminocyclohexyl)-4- (2,3- dichlorophenyl)pyri...)
Show SMILES NC1CCCC(C1)n1ccc(cc1=O)-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C17H18Cl2N2O/c18-15-6-2-5-14(17(15)19)11-7-8-21(16(22)9-11)13-4-1-3-12(20)10-13/h2,5-9,12-13H,1,3-4,10,20H2
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433315
PNG
((S)-3-(1-amino-1,3- dihydrospiro[indene-2,4'- pipe...)
Show SMILES N[C@@H]1c2ccccc2CC11CCN(CC1)c1ncc(Sc2cccc(Cl)c2Cl)[nH]c1=O
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433302
PNG
((S)-3-(4-amino-2-oxa-8- azaspiro[4.5]decan-8-yl)- ...)
Show SMILES N[C@@H]1COCC11CCN(CC1)c1ncc(Sc2cccc(Cl)c2Cl)[nH]c1=O
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433304
PNG
(N-(3-((5-(4- (aminomethyl)-4- methylpiperidin-1-yl...)
Show SMILES CC1(CN)CCN(CC1)c1ncc(Sc2cccc(NC(=O)c3c(O)nc4CCCCn4c3=O)c2Cl)[nH]c1=O
Show InChI InChI=1S/C26H30ClN7O4S/c1-26(14-28)8-11-33(12-9-26)21-24(37)32-18(13-29-21)39-16-6-4-5-15(20(16)27)30-22(35)19-23(36)31-17-7-2-3-10-34(17)25(19)38/h4-6,13,36H,2-3,7-12,14,28H2,1H3,(H,30,35)(H,32,37)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433317
PNG
((S)-3-(4-amino-2-oxa-8- azaspiro[4.5]decan-8-yl)- ...)
Show SMILES N[C@@H]1COCC11CCN(CC1)c1ncc(Sc2ccnc(Cl)c2Cl)[nH]c1=O
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433294
PNG
(6-((2-amino-3- chloropyridin-4-yl)thio)-3- ((3S,4S...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3ccnc(N)c3Cl)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433295
PNG
(N-(3-((5-(4- (aminomethyl)-4- methylpiperidin-1-yl...)
Show SMILES CC1(CN)CCN(CC1)c1ncc(Sc2cccc(NC(=O)c3c(O)nc4sccn4c3=O)c2Cl)[nH]c1=O
Show InChI InChI=1S/C24H24ClN7O4S2/c1-24(12-26)5-7-31(8-6-24)18-21(35)29-15(11-27-18)38-14-4-2-3-13(17(14)25)28-19(33)16-20(34)30-23-32(22(16)36)9-10-37-23/h2-4,9-11,34H,5-8,12,26H2,1H3,(H,28,33)(H,29,35)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433306
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES COc1nccc(Sc2cnc(N3CCC4(CO[C@@H](C)[C@H]4N)CC3)c(=O)[nH]2)c1Cl
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433307
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3ccnc(Cl)c3Cl)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433313
PNG
(3-(2- aminospiro[bicyclo[3.1.0] hexane-3,4'-piperi...)
Show SMILES NC1C2CC2CC11CCN(CC1)c1ncc(Sc2cccc(Cl)c2Cl)[nH]c1=O
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433300
PNG
(N-(3-((5-(4- (aminomethyl)-4- methylpiperidin-1-yl...)
Show SMILES CC1(CN)CCN(CC1)c1ncc(Sc2cccc(NC(=O)c3c(O)nc4cnccn4c3=O)c2Cl)[nH]c1=O
Show InChI InChI=1S/C25H25ClN8O4S/c1-25(13-27)5-8-33(9-6-25)20-23(37)32-17(12-29-20)39-15-4-2-3-14(19(15)26)30-21(35)18-22(36)31-16-11-28-7-10-34(16)24(18)38/h2-4,7,10-12,36H,5-6,8-9,13,27H2,1H3,(H,30,35)(H,32,37)
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433314
PNG
(3-(6-amino-3- azabicyclo[3.1.0]hexan-3- yl)-6-((2,...)
Show SMILES NC1C2CN(CC12)c1ncc(Sc2cccc(Cl)c2Cl)[nH]c1=O
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433309
PNG
(3-((3S,4S)-4-amino-3- methyl-2-oxa-8- azaspiro[4.5...)
Show SMILES C[C@@H]1OCC2(CCN(CC2)c2ncc(Sc3cc[nH]c(=O)c3Cl)[nH]c2=O)[C@@H]1N
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SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 2C


(Homo sapiens (Human))
BDBM433291
PNG
(6-(4-(aminomethyl)-4- methylpiperidin-1-yl)-3- (2,...)
Show SMILES CC1(CN)CCN(CC1)c1nc2[nH]nc(Oc3cccc(Cl)c3Cl)c2c(=O)[nH]1
Show InChI InChI=1S/C18H20Cl2N6O2/c1-18(9-21)5-7-26(8-6-18)17-22-14-12(15(27)23-17)16(25-24-14)28-11-4-2-3-10(19)13(11)20/h2-4H,5-9,21H2,1H3,(H2,22,23,24,25,27)
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n/an/a<50n/an/an/an/an/an/a



SYNBLia Therapeutics, Inc.

US Patent


Assay Description
IC50 values were determined at room temperature in 384-well black polystyrene plate, using a final reaction volume of 15 μl and the following as...


US Patent US10561655 (2020)


BindingDB Entry DOI: 10.7270/Q23F4S2Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%