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Patent code US9675614

Compile Data Set for Download or QSAR

Found 334 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
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176835
PNG
(US9675614, 15)
Show SMILES OC(CNC(=O)c1cccc(CNC2CCOCC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H33N3O3/c29-24(18-28-11-8-20-5-1-2-6-22(20)17-28)16-27-25(30)21-7-3-4-19(14-21)15-26-23-9-12-31-13-10-23/h1-7,14,23-24,26,29H,8-13,15-18H2,(H,27,30)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176840
PNG
(US9675614, 19)
Show SMILES O[C@H](CNC(=O)c1cccc(c1)-c1ccccn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H25N3O2/c28-22(17-27-13-11-18-6-1-2-7-21(18)16-27)15-26-24(29)20-9-5-8-19(14-20)23-10-3-4-12-25-23/h1-10,12,14,22,28H,11,13,15-17H2,(H,26,29)/t22-/m1/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176865
PNG
(US9675614, 37)
Show SMILES OC(CNC(=O)c1cccc(c1)C1CCNC1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H29N3O2/c27-22(16-26-11-9-17-4-1-2-5-21(17)15-26)14-25-23(28)19-7-3-6-18(12-19)20-8-10-24-13-20/h1-7,12,20,22,24,27H,8-11,13-16H2,(H,25,28)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176869
PNG
(US9675614, 41)
Show SMILES CCN(C1CCOCC1)c1cccc(C(=O)NCC(O)CN2CCc3ccccc3C2)c1C
Show InChI InChI=1S/C27H37N3O3/c1-3-30(23-12-15-33-16-13-23)26-10-6-9-25(20(26)2)27(32)28-17-24(31)19-29-14-11-21-7-4-5-8-22(21)18-29/h4-10,23-24,31H,3,11-19H2,1-2H3,(H,28,32)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176954
PNG
(US9675614, 92)
Show SMILES OC(CNC(=O)c1cccc(CN2CCN(CC(F)(F)F)CC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C26H33F3N4O2/c27-26(28,29)19-32-12-10-31(11-13-32)16-20-4-3-7-22(14-20)25(35)30-15-24(34)18-33-9-8-21-5-1-2-6-23(21)17-33/h1-7,14,24,34H,8-13,15-19H2,(H,30,35)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176963
PNG
(US9675614, 96)
Show SMILES Cc1ccc(NC2CCOC2)cc1C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H31N3O3/c1-17-6-7-20(26-21-9-11-30-16-21)12-23(17)24(29)25-13-22(28)15-27-10-8-18-4-2-3-5-19(18)14-27/h2-7,12,21-22,26,28H,8-11,13-16H2,1H3,(H,25,29)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177007
PNG
(US9675614, 124)
Show SMILES CC(=O)N1CCC(CC1)Nc1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C26H34N4O3/c1-19(31)30-13-10-23(11-14-30)28-24-8-4-7-21(15-24)26(33)27-16-25(32)18-29-12-9-20-5-2-3-6-22(20)17-29/h2-8,15,23,25,28,32H,9-14,16-18H2,1H3,(H,27,33)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177014
PNG
(US9675614, 128)
Show SMILES OC(CNC(=O)c1ccc(NC2CCN(CC(F)(F)F)CC2)cc1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C26H33F3N4O2/c27-26(28,29)18-32-13-10-23(11-14-32)31-22-7-5-20(6-8-22)25(35)30-15-24(34)17-33-12-9-19-3-1-2-4-21(19)16-33/h1-8,23-24,31,34H,9-18H2,(H,30,35)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177015
PNG
(US9675614, 129)
Show SMILES OC(CNC(=O)c1ccc(NC2CCOC2)cc1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H29N3O3/c27-22(15-26-11-9-17-3-1-2-4-19(17)14-26)13-24-23(28)18-5-7-20(8-6-18)25-21-10-12-29-16-21/h1-8,21-22,25,27H,9-16H2,(H,24,28)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177671
PNG
(US9675614, 133)
Show SMILES OC(CNC(=O)c1cccc(OCCN2CCOCC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H33N3O4/c29-23(19-28-9-8-20-4-1-2-5-22(20)18-28)17-26-25(30)21-6-3-7-24(16-21)32-15-12-27-10-13-31-14-11-27/h1-7,16,23,29H,8-15,17-19H2,(H,26,30)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177720
PNG
(US9675614, 138 | US9675614, 142 | US9675614, 152)
Show SMILES OC(CNC(=O)c1ccc(NC2CCNCC2)cc1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H32N4O2/c29-23(17-28-14-11-18-3-1-2-4-20(18)16-28)15-26-24(30)19-5-7-21(8-6-19)27-22-9-12-25-13-10-22/h1-8,22-23,25,27,29H,9-17H2,(H,26,30)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177728
PNG
(US9675614, 146)
Show SMILES COCCCOc1ccc(cc1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H30N2O4/c1-28-13-4-14-29-22-9-7-19(8-10-22)23(27)24-15-21(26)17-25-12-11-18-5-2-3-6-20(18)16-25/h2-3,5-10,21,26H,4,11-17H2,1H3,(H,24,27)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177735
PNG
(US9675614, 153)
Show SMILES CC1CC(CC(C)O1)Nc1cccc(c1)C(=O)NC[C@@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C26H35N3O3/c1-18-12-24(13-19(2)32-18)28-23-9-5-8-21(14-23)26(31)27-15-25(30)17-29-11-10-20-6-3-4-7-22(20)16-29/h3-9,14,18-19,24-25,28,30H,10-13,15-17H2,1-2H3,(H,27,31)/t18?,19?,24?,25-/m1/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178086
PNG
(US9675614, 189)
Show SMILES O[C@@H](CNC(=O)c1ccnc(NCc2ccncc2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H27N5O2/c30-22(17-29-12-8-19-3-1-2-4-21(19)16-29)15-28-24(31)20-7-11-26-23(13-20)27-14-18-5-9-25-10-6-18/h1-7,9-11,13,22,30H,8,12,14-17H2,(H,26,27)(H,28,31)/t22-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178147
PNG
(US9675614, 193)
Show SMILES O[C@@H](CNC(=O)c1cc(NC2CCOCC2)ncn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C22H29N5O3/c28-19(14-27-8-5-16-3-1-2-4-17(16)13-27)12-23-22(29)20-11-21(25-15-24-20)26-18-6-9-30-10-7-18/h1-4,11,15,18-19,28H,5-10,12-14H2,(H,23,29)(H,24,25,26)/t19-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178151
PNG
(US9675614, 197)
Show SMILES CC(=O)N1CCC(C1)Oc1ccc(cc1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H31N3O4/c1-18(29)28-13-11-24(17-28)32-23-8-6-20(7-9-23)25(31)26-14-22(30)16-27-12-10-19-4-2-3-5-21(19)15-27/h2-9,22,24,30H,10-17H2,1H3,(H,26,31)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178157
PNG
(US9675614, 201)
Show SMILES O[C@@H](CNC(=O)c1ccnc(NC2CCNC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C22H29N5O2/c28-20(15-27-10-7-16-3-1-2-4-18(16)14-27)13-25-22(29)17-5-9-24-21(11-17)26-19-6-8-23-12-19/h1-5,9,11,19-20,23,28H,6-8,10,12-15H2,(H,24,26)(H,25,29)/t19?,20-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178159
PNG
(US9675614, 203)
Show SMILES O[C@@H](CNC(=O)c1ccnc(OC2CCN(CC(F)(F)F)CC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H31F3N4O3/c26-25(27,28)17-31-11-7-22(8-12-31)35-23-13-19(5-9-29-23)24(34)30-14-21(33)16-32-10-6-18-3-1-2-4-20(18)15-32/h1-5,9,13,21-22,33H,6-8,10-12,14-17H2,(H,30,34)/t21-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178161
PNG
(US9675614, 205 | US9675614, 207)
Show SMILES CC(=O)N1CCC(CC1)Oc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H32N4O4/c1-18(30)29-12-8-23(9-13-29)33-24-14-20(6-10-26-24)25(32)27-15-22(31)17-28-11-7-19-4-2-3-5-21(19)16-28/h2-6,10,14,22-23,31H,7-9,11-13,15-17H2,1H3,(H,27,32)/t22-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178162
PNG
(US9675614, 206)
Show SMILES CN1CCC(CC1)Oc1cc(ncn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H31N5O3/c1-27-9-7-20(8-10-27)31-22-12-21(25-16-26-22)23(30)24-13-19(29)15-28-11-6-17-4-2-3-5-18(17)14-28/h2-5,12,16,19-20,29H,6-11,13-15H2,1H3,(H,24,30)/t19-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178904
PNG
(US9675614, 229)
Show SMILES O[C@@H](CNC(=O)c1ccnc(OC2CCNCC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H30N4O3/c28-20(16-27-12-8-17-3-1-2-4-19(17)15-27)14-26-23(29)18-5-11-25-22(13-18)30-21-6-9-24-10-7-21/h1-5,11,13,20-21,24,28H,6-10,12,14-16H2,(H,26,29)/t20-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178911
PNG
(US9675614, 236)
Show SMILES O[C@@H](CNC(=O)c1ccnc(NCC2CCCNC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H33N5O2/c30-22(17-29-11-8-19-5-1-2-6-21(19)16-29)15-28-24(31)20-7-10-26-23(12-20)27-14-18-4-3-9-25-13-18/h1-2,5-7,10,12,18,22,25,30H,3-4,8-9,11,13-17H2,(H,26,27)(H,28,31)/t18?,22-/m0/s1
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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179192
PNG
(US9675614, 255)
Show SMILES CN1CCC(C1)Nc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H31N5O2/c1-27-10-8-20(15-27)26-22-12-18(6-9-24-22)23(30)25-13-21(29)16-28-11-7-17-4-2-3-5-19(17)14-28/h2-6,9,12,20-21,29H,7-8,10-11,13-16H2,1H3,(H,24,26)(H,25,30)/t20?,21-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179194
PNG
(US9675614, 257)
Show SMILES CS(=O)(=O)N1CCC(C1)Nc1cc(ncn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C22H30N6O4S/c1-33(31,32)28-9-7-18(13-28)26-21-10-20(24-15-25-21)22(30)23-11-19(29)14-27-8-6-16-4-2-3-5-17(16)12-27/h2-5,10,15,18-19,29H,6-9,11-14H2,1H3,(H,23,30)(H,24,25,26)/t18?,19-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179216
PNG
(US9675614, 266)
Show SMILES CC(=O)N1CC[C@@H](C1)Nc1cccc(c1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H32N4O3/c1-18(30)29-12-10-23(16-29)27-22-8-4-7-20(13-22)25(32)26-14-24(31)17-28-11-9-19-5-2-3-6-21(19)15-28/h2-8,13,23-24,27,31H,9-12,14-17H2,1H3,(H,26,32)/t23-,24-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179232
PNG
(US9675614, 278)
Show SMILES CS(=O)(=O)N1CC(C1)Nc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C22H29N5O4S/c1-32(30,31)27-13-19(14-27)25-21-10-17(6-8-23-21)22(29)24-11-20(28)15-26-9-7-16-4-2-3-5-18(16)12-26/h2-6,8,10,19-20,28H,7,9,11-15H2,1H3,(H,23,25)(H,24,29)/t20-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179234
PNG
(US9675614, 280)
Show SMILES O[C@@H](CNC(=O)c1cc(NC2CNC2)ncn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C20H26N6O2/c27-17(12-26-6-5-14-3-1-2-4-15(14)11-26)10-22-20(28)18-7-19(24-13-23-18)25-16-8-21-9-16/h1-4,7,13,16-17,21,27H,5-6,8-12H2,(H,22,28)(H,23,24,25)/t17-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179259
PNG
(US9675614, 297)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1cc(ncn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H32N6O4S/c1-34(32,33)29-10-7-19(8-11-29)27-22-12-21(25-16-26-22)23(31)24-13-20(30)15-28-9-6-17-4-2-3-5-18(17)14-28/h2-5,12,16,19-20,30H,6-11,13-15H2,1H3,(H,24,31)(H,25,26,27)/t20-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179386
PNG
(US9675614, 307)
Show SMILES Cc1cnc(NC2CCOCC2)cc1C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H32N4O3/c1-17-13-25-23(27-20-7-10-31-11-8-20)12-22(17)24(30)26-14-21(29)16-28-9-6-18-4-2-3-5-19(18)15-28/h2-5,12-13,20-21,29H,6-11,14-16H2,1H3,(H,25,27)(H,26,30)/t21-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM179397
PNG
(US9675614, 318)
Show SMILES O[C@@H](CNC(=O)c1ccc2cc(O)ccc2c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H24N2O3/c26-21-8-7-17-11-19(6-5-18(17)12-21)23(28)24-13-22(27)15-25-10-9-16-3-1-2-4-20(16)14-25/h1-8,11-12,22,26-27H,9-10,13-15H2,(H,24,28)/t22-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176815
PNG
(US9675614, 1)
Show SMILES OC(CNC(=O)c1cccc(c1)-c1ccccn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H25N3O2/c28-22(17-27-13-11-18-6-1-2-7-21(18)16-27)15-26-24(29)20-9-5-8-19(14-20)23-10-3-4-12-25-23/h1-10,12,14,22,28H,11,13,15-17H2,(H,26,29)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176816
PNG
(US9675614, 2)
Show SMILES Cn1nccc1-c1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H26N4O2/c1-26-22(9-11-25-26)18-7-4-8-19(13-18)23(29)24-14-21(28)16-27-12-10-17-5-2-3-6-20(17)15-27/h2-9,11,13,21,28H,10,12,14-16H2,1H3,(H,24,29)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176841
PNG
(US9675614, 20)
Show SMILES O[C@@H](CNC(=O)c1cccc(c1)-c1ccccn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H25N3O2/c28-22(17-27-13-11-18-6-1-2-7-21(18)16-27)15-26-24(29)20-9-5-8-19(14-20)23-10-3-4-12-25-23/h1-10,12,14,22,28H,11,13,15-17H2,(H,26,29)/t22-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176930
PNG
(US9675614, 78)
Show SMILES OC(CNC(=O)c1cc(F)cc(NC2CCOCC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H30FN3O3/c25-20-11-19(12-22(13-20)27-21-6-9-31-10-7-21)24(30)26-14-23(29)16-28-8-5-17-3-1-2-4-18(17)15-28/h1-4,11-13,21,23,27,29H,5-10,14-16H2,(H,26,30)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM176960
PNG
(US9675614, 94)
Show SMILES OC(CNC(=O)c1cccc(NC2CCNCC2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H32N4O2/c29-23(17-28-13-10-18-4-1-2-5-20(18)16-28)15-26-24(30)19-6-3-7-22(14-19)27-21-8-11-25-12-9-21/h1-7,14,21,23,25,27,29H,8-13,15-17H2,(H,26,30)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177001
PNG
(US9675614, 118)
Show SMILES CN(C)C(=O)CNCc1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H32N4O3/c1-27(2)23(30)15-25-13-18-6-5-9-20(12-18)24(31)26-14-22(29)17-28-11-10-19-7-3-4-8-21(19)16-28/h3-9,12,22,25,29H,10-11,13-17H2,1-2H3,(H,26,31)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177017
PNG
(US9675614, 131)
Show SMILES CN(C1CCN(C)CC1)c1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C26H36N4O2/c1-28-13-11-23(12-14-28)29(2)24-9-5-8-21(16-24)26(32)27-17-25(31)19-30-15-10-20-6-3-4-7-22(20)18-30/h3-9,16,23,25,31H,10-15,17-19H2,1-2H3,(H,27,32)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177003
PNG
(US9675614, 120 | US9675614, 134)
Show SMILES CN1CCC(C1)Oc1cccc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H31N3O3/c1-26-11-10-23(17-26)30-22-8-4-7-19(13-22)24(29)25-14-21(28)16-27-12-9-18-5-2-3-6-20(18)15-27/h2-8,13,21,23,28H,9-12,14-17H2,1H3,(H,25,29)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177720
PNG
(US9675614, 138 | US9675614, 142 | US9675614, 152)
Show SMILES OC(CNC(=O)c1ccc(NC2CCNCC2)cc1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H32N4O2/c29-23(17-28-14-11-18-3-1-2-4-20(18)16-28)15-26-24(30)19-5-7-21(8-6-19)27-22-9-12-25-13-10-22/h1-8,22-23,25,27,29H,9-17H2,(H,26,30)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177742
PNG
(US9675614, 160)
Show SMILES COc1cc(CN2CCN(C)CC2)cc(c1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C26H36N4O3/c1-28-9-11-29(12-10-28)17-20-13-23(15-25(14-20)33-2)26(32)27-16-24(31)19-30-8-7-21-5-3-4-6-22(21)18-30/h3-6,13-15,24,31H,7-12,16-19H2,1-2H3,(H,27,32)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177909
PNG
(US9675614, 163)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)NCC(O)CN2CCc3ccccc3C2)CC1
Show InChI InChI=1S/C25H34N4O2/c1-27-12-14-28(15-13-27)17-20-6-8-22(9-7-20)25(31)26-16-24(30)19-29-11-10-21-4-2-3-5-23(21)18-29/h2-9,24,30H,10-19H2,1H3,(H,26,31)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM177922
PNG
(US9675614, 166)
Show SMILES O[C@@H](CNC(=O)c1cc(NC2COC2)ncn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C20H25N5O3/c26-17(10-25-6-5-14-3-1-2-4-15(14)9-25)8-21-20(27)18-7-19(23-13-22-18)24-16-11-28-12-16/h1-4,7,13,16-17,26H,5-6,8-12H2,(H,21,27)(H,22,23,24)/t17-/m0/s1
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178152
PNG
(US9675614, 198)
Show SMILES CS(=O)(=O)N1CCC(C1)Oc1ccc(cc1)C(=O)NCC(O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H31N3O5S/c1-33(30,31)27-13-11-23(17-27)32-22-8-6-19(7-9-22)24(29)25-14-21(28)16-26-12-10-18-4-2-3-5-20(18)15-26/h2-9,21,23,28H,10-17H2,1H3,(H,25,29)
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Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178155
PNG
(US9675614, 199)
Show SMILES OC(CNC(=O)c1ccc(OC2CCN(CC(F)(F)F)C2)cc1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H30F3N3O3/c26-25(27,28)17-31-12-10-23(16-31)34-22-7-5-19(6-8-22)24(33)29-13-21(32)15-30-11-9-18-3-1-2-4-20(18)14-30/h1-8,21,23,32H,9-17H2,(H,29,33)
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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178168
PNG
(US9675614, 209)
Show SMILES O[C@@H](CNC(=O)c1cc(NC2CCNC2)ncn1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C21H28N6O2/c28-18(13-27-8-6-15-3-1-2-4-16(15)12-27)11-23-21(29)19-9-20(25-14-24-19)26-17-5-7-22-10-17/h1-4,9,14,17-18,22,28H,5-8,10-13H2,(H,23,29)(H,24,25,26)/t17?,18-/m0/s1
PDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178174
PNG
(US9675614, 212)
Show SMILES C[C@@H]1COCCC1Nc1cccc(c1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C25H33N3O3/c1-18-17-31-12-10-24(18)27-22-8-4-7-20(13-22)25(30)26-14-23(29)16-28-11-9-19-5-2-3-6-21(19)15-28/h2-8,13,18,23-24,27,29H,9-12,14-17H2,1H3,(H,26,30)/t18-,23+,24?/m1/s1
PDB

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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178769
PNG
(US9675614, 219)
Show SMILES Cc1ccc2cc(ccc2n1)C(=O)NC[C@@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H25N3O2/c1-16-6-7-18-12-19(8-9-22(18)25-16)23(28)24-13-21(27)15-26-11-10-17-4-2-3-5-20(17)14-26/h2-9,12,21,27H,10-11,13-15H2,1H3,(H,24,28)/t21-/m1/s1
PDB

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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178896
PNG
(US9675614, 221)
Show SMILES Cc1ccc2cc(ccc2n1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C23H25N3O2/c1-16-6-7-18-12-19(8-9-22(18)25-16)23(28)24-13-21(27)15-26-11-10-17-4-2-3-5-20(17)14-26/h2-9,12,21,27H,10-11,13-15H2,1H3,(H,24,28)/t21-/m0/s1
PDB

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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178901
PNG
(US9675614, 226)
Show SMILES O[C@@H](CNC(=O)c1ccnc(NC2CCN(CC(F)(F)F)C2)c1)CN1CCc2ccccc2C1
Show InChI InChI=1S/C24H30F3N5O2/c25-24(26,27)16-32-10-7-20(14-32)30-22-11-18(5-8-28-22)23(34)29-12-21(33)15-31-9-6-17-3-1-2-4-19(17)13-31/h1-5,8,11,20-21,33H,6-7,9-10,12-16H2,(H,28,30)(H,29,34)/t20?,21-/m0/s1
PDB

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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

More data for this
Ligand-Target Pair
PRMT5/MeP50


(Homo sapiens (Human))
BDBM178909
PNG
(US9675614, 234)
Show SMILES CN(C)CCOc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1
Show InChI InChI=1S/C22H30N4O3/c1-25(2)11-12-29-21-13-18(7-9-23-21)22(28)24-14-20(27)16-26-10-8-17-5-3-4-6-19(17)15-26/h3-7,9,13,20,27H,8,10-12,14-16H2,1-2H3,(H,24,28)/t20-/m0/s1
PDB

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n/an/a<100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....


US Patent US9675614 (2017)

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