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Patent code US10793575

Compile Data Set for Download or QSAR
Found 89 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
btk (wt


(Homo sapiens (Human))
BDBM50357312
PNG
(IBRUTINIB | PCI-32765 | US10124003, Ref. Ex. Compo...)
Show SMILES Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
Show InChI InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m1/s1
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n/an/a 0.210n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
btk (wt


(Homo sapiens (Human))
BDBM468314
PNG
(2-{3-[2-amino-6- (1,1-dioxido-3,6- dihydro-2H- thi...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCS(=O)(=O)CC1
Show InChI InChI=1S/C30H26FN5O4S/c31-23-13-19(16-4-5-16)12-18-6-9-36(29(38)26(18)23)25-3-1-2-20(22(25)15-37)27-21-14-24(33-28(21)35-30(32)34-27)17-7-10-41(39,40)11-8-17/h1-3,6-7,9,12-14,16,37H,4-5,8,10-11,15H2,(H3,32,33,34,35)
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n/an/a 0.25n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465733
PNG
(2-[3-(2-amino-6-{4-[(4-methylpiperazin- 1-yl)methy...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cc3c(nc(N)nc3[nH]2)-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)CC1
Show InChI InChI=1S/C37H36FN7O2/c1-43-13-15-44(16-14-43)20-22-5-7-24(8-6-22)31-19-28-34(41-37(39)42-35(28)40-31)27-3-2-4-32(29(27)21-46)45-12-11-25-17-26(23-9-10-23)18-30(38)33(25)36(45)47/h2-8,11-12,17-19,23,46H,9-10,13-16,20-21H2,1H3,(H3,39,40,41,42)
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n/an/a 0.330n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468318
PNG
(2-(3-{2-amino-6-[1- (methylsulfonyl)- 1,2,3,6- tet...)
Show SMILES CS(=O)(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C31H29FN6O4S/c1-43(41,42)37-10-7-18(8-11-37)25-15-22-28(35-31(33)36-29(22)34-25)21-3-2-4-26(23(21)16-39)38-12-9-19-13-20(17-5-6-17)14-24(32)27(19)30(38)40/h2-4,7,9,12-15,17,39H,5-6,8,10-11,16H2,1H3,(H3,33,34,35,36)
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n/an/a 0.340n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468311
PNG
(2-{3-[2-amino-6-(4- {[4-(2-hydroxy- ethyl)piperazi...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCN(CCO)CC2)cc1
Show InChI InChI=1S/C38H38FN7O3/c39-31-19-27(24-8-9-24)18-26-10-11-46(37(49)34(26)31)33-3-1-2-28(30(33)22-48)35-29-20-32(41-36(29)43-38(40)42-35)25-6-4-23(5-7-25)21-45-14-12-44(13-15-45)16-17-47/h1-7,10-11,18-20,24,47-48H,8-9,12-17,21-22H2,(H3,40,41,42,43)
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n/an/a 0.360n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468313
PNG
(2-(3-{2-amino-6- [1-(4-methylpiperazine-1- carbony...)
Show SMILES CN1CCN(CC1)C(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C36H37FN8O3/c1-42-13-15-44(16-14-42)36(48)43-10-7-22(8-11-43)29-19-26-32(40-35(38)41-33(26)39-29)25-3-2-4-30(27(25)20-46)45-12-9-23-17-24(21-5-6-21)18-28(37)31(23)34(45)47/h2-4,7,9,12,17-19,21,46H,5-6,8,10-11,13-16,20H2,1H3,(H3,38,39,40,41)
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n/an/a 0.390n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468315
PNG
(2-{3-[2-amino-6- (1-propionyl-1,2,3,6- tetrahydrop...)
Show SMILES CCC(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C33H31FN6O3/c1-2-28(42)39-11-8-19(9-12-39)26-16-23-30(37-33(35)38-31(23)36-26)22-4-3-5-27(24(22)17-41)40-13-10-20-14-21(18-6-7-18)15-25(34)29(20)32(40)43/h3-5,8,10,13-16,18,41H,2,6-7,9,11-12,17H2,1H3,(H3,35,36,37,38)
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n/an/a 0.410n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468320
PNG
(2-{3-[2-amino-6-(1,2,3,6- tetrahydropyridin-4-yl)-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCNCC1
Show InChI InChI=1S/C30H27FN6O2/c31-23-13-19(16-4-5-16)12-18-8-11-37(29(39)26(18)23)25-3-1-2-20(22(25)15-38)27-21-14-24(17-6-9-33-10-7-17)34-28(21)36-30(32)35-27/h1-3,6,8,11-14,16,33,38H,4-5,7,9-10,15H2,(H3,32,34,35,36)
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n/an/a 0.410n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465733
PNG
(2-[3-(2-amino-6-{4-[(4-methylpiperazin- 1-yl)methy...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cc3c(nc(N)nc3[nH]2)-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)CC1
Show InChI InChI=1S/C37H36FN7O2/c1-43-13-15-44(16-14-43)20-22-5-7-24(8-6-22)31-19-28-34(41-37(39)42-35(28)40-31)27-3-2-4-32(29(27)21-46)45-12-11-25-17-26(23-9-10-23)18-30(38)33(25)36(45)47/h2-8,11-12,17-19,23,46H,9-10,13-16,20-21H2,1H3,(H3,39,40,41,42)
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n/an/a 0.430n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468308
PNG
(2-[3-(2-amino-6-{4- [(diethyl- amino)methyl]phenyl...)
Show SMILES CCN(CC)Cc1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C36H35FN6O2/c1-3-42(4-2)19-21-8-10-23(11-9-21)30-18-27-33(40-36(38)41-34(27)39-30)26-6-5-7-31(28(26)20-44)43-15-14-24-16-25(22-12-13-22)17-29(37)32(24)35(43)45/h5-11,14-18,22,44H,3-4,12-13,19-20H2,1-2H3,(H3,38,39,40,41)
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n/an/a 0.430n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468307
PNG
(2-[3-(2-amino-6-{4- [(dimethyl- amino)methyl]pheny...)
Show SMILES CN(C)Cc1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C34H31FN6O2/c1-40(2)17-19-6-8-21(9-7-19)28-16-25-31(38-34(36)39-32(25)37-28)24-4-3-5-29(26(24)18-42)41-13-12-22-14-23(20-10-11-20)15-27(35)30(22)33(41)43/h3-9,12-16,20,42H,10-11,17-18H2,1-2H3,(H3,36,37,38,39)
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n/an/a 0.430n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465748
PNG
(2-(3-{2-amino-6-[1-(oxetan-3-yl)-1,2,3,6-tetrahydr...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCN(CC1)C1COC1
Show InChI InChI=1S/C33H31FN6O3/c34-26-13-21(18-4-5-18)12-20-8-11-40(32(42)29(20)26)28-3-1-2-23(25(28)15-41)30-24-14-27(36-31(24)38-33(35)37-30)19-6-9-39(10-7-19)22-16-43-17-22/h1-3,6,8,11-14,18,22,41H,4-5,7,9-10,15-17H2,(H3,35,36,37,38)
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n/an/a 0.460n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468312
PNG
(2-[3-(2-amino-6-{4- [(3-oxopiperazin-1- yl)methyl]...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCNC(=O)C2)cc1
Show InChI InChI=1S/C36H32FN7O3/c37-28-15-24(21-8-9-21)14-23-10-12-44(35(47)32(23)28)30-3-1-2-25(27(30)19-45)33-26-16-29(40-34(26)42-36(38)41-33)22-6-4-20(5-7-22)17-43-13-11-39-31(46)18-43/h1-7,10,12,14-16,21,45H,8-9,11,13,17-19H2,(H,39,46)(H3,38,40,41,42)
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n/an/a 0.470n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468319
PNG
(2-{3-[2-amino-6-(1- ethyl-1,2,3,6- tetrahydropyrid...)
Show SMILES CCN1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H31FN6O2/c1-2-38-11-8-19(9-12-38)26-16-23-29(36-32(34)37-30(23)35-26)22-4-3-5-27(24(22)17-40)39-13-10-20-14-21(18-6-7-18)15-25(33)28(20)31(39)41/h3-5,8,10,13-16,18,40H,2,6-7,9,11-12,17H2,1H3,(H3,34,35,36,37)
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n/an/a 0.470n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465738
PNG
(2-{3-[2-amino-6-(1-methyl-1H-pyrazol- 4-yl)-7H-pyr...)
Show SMILES Cn1cc(cn1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C29H24FN7O2/c1-36-13-18(12-32-36)23-11-20-26(34-29(31)35-27(20)33-23)19-3-2-4-24(21(19)14-38)37-8-7-16-9-17(15-5-6-15)10-22(30)25(16)28(37)39/h2-4,7-13,15,38H,5-6,14H2,1H3,(H3,31,33,34,35)
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n/an/a 0.490n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468309
PNG
(2-(3-{2-amino-6-[4- (pyrrolidin-1- ylmethyl)phenyl...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCCC2)cc1
Show InChI InChI=1S/C36H33FN6O2/c37-29-17-25(22-10-11-22)16-24-12-15-43(35(45)32(24)29)31-5-3-4-26(28(31)20-44)33-27-18-30(39-34(27)41-36(38)40-33)23-8-6-21(7-9-23)19-42-13-1-2-14-42/h3-9,12,15-18,22,44H,1-2,10-11,13-14,19-20H2,(H3,38,39,40,41)
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n/an/a 0.510n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468316
PNG
(4-{2-amino-4-[3- (6-cyclopropyl-8- fluoro-1-oxoiso...)
Show SMILES CN(C)C(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C33H32FN7O3/c1-39(2)33(44)40-11-8-19(9-12-40)26-16-23-29(37-32(35)38-30(23)36-26)22-4-3-5-27(24(22)17-42)41-13-10-20-14-21(18-6-7-18)15-25(34)28(20)31(41)43/h3-5,8,10,13-16,18,42H,6-7,9,11-12,17H2,1-2H3,(H3,35,36,37,38)
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n/an/a 0.520n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468311
PNG
(2-{3-[2-amino-6-(4- {[4-(2-hydroxy- ethyl)piperazi...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCN(CCO)CC2)cc1
Show InChI InChI=1S/C38H38FN7O3/c39-31-19-27(24-8-9-24)18-26-10-11-46(37(49)34(26)31)33-3-1-2-28(30(33)22-48)35-29-20-32(41-36(29)43-38(40)42-35)25-6-4-23(5-7-25)21-45-14-12-44(13-15-45)16-17-47/h1-7,10-11,18-20,24,47-48H,8-9,12-17,21-22H2,(H3,40,41,42,43)
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n/an/a 0.570n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468310
PNG
(2-(3-{2-amino-6-[4- (piperidin-1- ylmethyl)phenyl]...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C37H35FN6O2/c38-30-18-26(23-11-12-23)17-25-13-16-44(36(46)33(25)30)32-6-4-5-27(29(32)21-45)34-28-19-31(40-35(28)42-37(39)41-34)24-9-7-22(8-10-24)20-43-14-2-1-3-15-43/h4-10,13,16-19,23,45H,1-3,11-12,14-15,20-21H2,(H3,39,40,41,42)
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n/an/a 0.580n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468313
PNG
(2-(3-{2-amino-6- [1-(4-methylpiperazine-1- carbony...)
Show SMILES CN1CCN(CC1)C(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C36H37FN8O3/c1-42-13-15-44(16-14-42)36(48)43-10-7-22(8-11-43)29-19-26-32(40-35(38)41-33(26)39-29)25-3-2-4-30(27(25)20-46)45-12-9-23-17-24(21-5-6-21)18-28(37)31(23)34(45)47/h2-4,7,9,12,17-19,21,46H,5-6,8,10-11,13-16,20H2,1H3,(H3,38,39,40,41)
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n/an/a 0.580n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468314
PNG
(2-{3-[2-amino-6- (1,1-dioxido-3,6- dihydro-2H- thi...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCS(=O)(=O)CC1
Show InChI InChI=1S/C30H26FN5O4S/c31-23-13-19(16-4-5-16)12-18-6-9-36(29(38)26(18)23)25-3-1-2-20(22(25)15-37)27-21-14-24(33-28(21)35-30(32)34-27)17-7-10-41(39,40)11-8-17/h1-3,6-7,9,12-14,16,37H,4-5,8,10-11,15H2,(H3,32,33,34,35)
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n/an/a 0.580n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465738
PNG
(2-{3-[2-amino-6-(1-methyl-1H-pyrazol- 4-yl)-7H-pyr...)
Show SMILES Cn1cc(cn1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C29H24FN7O2/c1-36-13-18(12-32-36)23-11-20-26(34-29(31)35-27(20)33-23)19-3-2-4-24(21(19)14-38)37-8-7-16-9-17(15-5-6-15)10-22(30)25(16)28(37)39/h2-4,7-13,15,38H,5-6,14H2,1H3,(H3,31,33,34,35)
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n/an/a 0.600n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468318
PNG
(2-(3-{2-amino-6-[1- (methylsulfonyl)- 1,2,3,6- tet...)
Show SMILES CS(=O)(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C31H29FN6O4S/c1-43(41,42)37-10-7-18(8-11-37)25-15-22-28(35-31(33)36-29(22)34-25)21-3-2-4-26(23(21)16-39)38-12-9-19-13-20(17-5-6-17)14-24(32)27(19)30(38)40/h2-4,7,9,12-15,17,39H,5-6,8,10-11,16H2,1H3,(H3,33,34,35,36)
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n/an/a 0.700n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465766
PNG
(2-(3-{2-amino-6-[4- (methylsulfonyl)phenyl]- 7H-py...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H26FN5O4S/c1-43(41,42)21-9-7-18(8-10-21)26-15-23-29(36-32(34)37-30(23)35-26)22-3-2-4-27(24(22)16-39)38-12-11-19-13-20(17-5-6-17)14-25(33)28(19)31(38)40/h2-4,7-15,17,39H,5-6,16H2,1H3,(H3,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468308
PNG
(2-[3-(2-amino-6-{4- [(diethyl- amino)methyl]phenyl...)
Show SMILES CCN(CC)Cc1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C36H35FN6O2/c1-3-42(4-2)19-21-8-10-23(11-9-21)30-18-27-33(40-36(38)41-34(27)39-30)26-6-5-7-31(28(26)20-44)43-15-14-24-16-25(22-12-13-22)17-29(37)32(24)35(43)45/h5-11,14-18,22,44H,3-4,12-13,19-20H2,1-2H3,(H3,38,39,40,41)
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n/an/a 0.760n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468306
PNG
(2-(3-{2-amino-6-[2- (methylamino)pyridin- 4-yl]-7H...)
Show SMILES CNc1cc(ccn1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C31H26FN7O2/c1-34-26-13-17(7-9-35-26)24-14-21-28(37-31(33)38-29(21)36-24)20-3-2-4-25(22(20)15-40)39-10-8-18-11-19(16-5-6-16)12-23(32)27(18)30(39)41/h2-4,7-14,16,40H,5-6,15H2,1H3,(H,34,35)(H3,33,36,37,38)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468307
PNG
(2-[3-(2-amino-6-{4- [(dimethyl- amino)methyl]pheny...)
Show SMILES CN(C)Cc1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C34H31FN6O2/c1-40(2)17-19-6-8-21(9-7-19)28-16-25-31(38-34(36)39-32(25)37-28)24-4-3-5-29(26(24)18-42)41-13-12-22-14-23(20-10-11-20)15-27(35)30(22)33(41)43/h3-9,12-16,20,42H,10-11,17-18H2,1-2H3,(H3,36,37,38,39)
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n/an/a 0.780n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468315
PNG
(2-{3-[2-amino-6- (1-propionyl-1,2,3,6- tetrahydrop...)
Show SMILES CCC(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C33H31FN6O3/c1-2-28(42)39-11-8-19(9-12-39)26-16-23-30(37-33(35)38-31(23)36-26)22-4-3-5-27(24(22)17-41)40-13-10-20-14-21(18-6-7-18)15-25(34)29(20)32(40)43/h3-5,8,10,13-16,18,41H,2,6-7,9,11-12,17H2,1H3,(H3,35,36,37,38)
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n/an/a 0.820n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468310
PNG
(2-(3-{2-amino-6-[4- (piperidin-1- ylmethyl)phenyl]...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C37H35FN6O2/c38-30-18-26(23-11-12-23)17-25-13-16-44(36(46)33(25)30)32-6-4-5-27(29(32)21-45)34-28-19-31(40-35(28)42-37(39)41-34)24-9-7-22(8-10-24)20-43-14-2-1-3-15-43/h4-10,13,16-19,23,45H,1-3,11-12,14-15,20-21H2,(H3,39,40,41,42)
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n/an/a 0.860n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465767
PNG
(2-{3-[2-amino-6-(6- fluoropyridin-2-yl)-7H- pyrrol...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1cccc(F)n1
Show InChI InChI=1S/C30H22F2N6O2/c31-21-12-17(15-7-8-15)11-16-9-10-38(29(40)26(16)21)24-5-1-3-18(20(24)14-39)27-19-13-23(22-4-2-6-25(32)34-22)35-28(19)37-30(33)36-27/h1-6,9-13,15,39H,7-8,14H2,(H3,33,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468309
PNG
(2-(3-{2-amino-6-[4- (pyrrolidin-1- ylmethyl)phenyl...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCCC2)cc1
Show InChI InChI=1S/C36H33FN6O2/c37-29-17-25(22-10-11-22)16-24-12-15-43(35(45)32(24)29)31-5-3-4-26(28(31)20-44)33-27-18-30(39-34(27)41-36(38)40-33)23-8-6-21(7-9-23)19-42-13-1-2-14-42/h3-9,12,15-18,22,44H,1-2,10-11,13-14,19-20H2,(H3,38,39,40,41)
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n/an/a 0.900n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468312
PNG
(2-[3-(2-amino-6-{4- [(3-oxopiperazin-1- yl)methyl]...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCNC(=O)C2)cc1
Show InChI InChI=1S/C36H32FN7O3/c37-28-15-24(21-8-9-21)14-23-10-12-44(35(47)32(23)28)30-3-1-2-25(27(30)19-45)33-26-16-29(40-34(26)42-36(38)41-33)22-6-4-20(5-7-22)17-43-13-11-39-31(46)18-43/h1-7,10,12,14-16,21,45H,8-9,11,13,17-19H2,(H,39,46)(H3,38,40,41,42)
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n/an/a 0.930n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM468317
PNG
(2-(3-{2-amino-6-[1- (pyrrolidine-1-carbonyl)- 1,2,...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCN(CC1)C(=O)N1CCCC1
Show InChI InChI=1S/C35H34FN7O3/c36-27-17-23(20-6-7-20)16-22-10-15-43(33(45)30(22)27)29-5-3-4-24(26(29)19-44)31-25-18-28(38-32(25)40-34(37)39-31)21-8-13-42(14-9-21)35(46)41-11-1-2-12-41/h3-5,8,10,15-18,20,44H,1-2,6-7,9,11-14,19H2,(H3,37,38,39,40)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468316
PNG
(4-{2-amino-4-[3- (6-cyclopropyl-8- fluoro-1-oxoiso...)
Show SMILES CN(C)C(=O)N1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C33H32FN7O3/c1-39(2)33(44)40-11-8-19(9-12-40)26-16-23-29(37-32(35)38-30(23)36-26)22-4-3-5-27(24(22)17-42)41-13-10-20-14-21(18-6-7-18)15-25(34)28(20)31(41)43/h3-5,8,10,13-16,18,42H,6-7,9,11-12,17H2,1-2H3,(H3,35,36,37,38)
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n/an/a 0.950n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465727
PNG
(2-[3-(2-amino-8-phenyl-9H-purin-6-yl)-2-(hydroxyme...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2nc([nH]c2n1)-c1ccccc1
Show InChI InChI=1S/C30H23FN6O2/c31-22-14-19(16-9-10-16)13-18-11-12-37(29(39)24(18)22)23-8-4-7-20(21(23)15-38)25-26-28(36-30(32)34-25)35-27(33-26)17-5-2-1-3-6-17/h1-8,11-14,16,38H,9-10,15H2,(H3,32,33,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465748
PNG
(2-(3-{2-amino-6-[1-(oxetan-3-yl)-1,2,3,6-tetrahydr...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCN(CC1)C1COC1
Show InChI InChI=1S/C33H31FN6O3/c34-26-13-21(18-4-5-18)12-20-8-11-40(32(42)29(20)26)28-3-1-2-23(25(28)15-41)30-24-14-27(36-31(24)38-33(35)37-30)19-6-9-39(10-7-19)22-16-43-17-22/h1-3,6,8,11-14,18,22,41H,4-5,7,9-10,15-17H2,(H3,35,36,37,38)
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n/an/a 0.990n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465727
PNG
(2-[3-(2-amino-8-phenyl-9H-purin-6-yl)-2-(hydroxyme...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2nc([nH]c2n1)-c1ccccc1
Show InChI InChI=1S/C30H23FN6O2/c31-22-14-19(16-9-10-16)13-18-11-12-37(29(39)24(18)22)23-8-4-7-20(21(23)15-38)25-26-28(36-30(32)34-25)35-27(33-26)17-5-2-1-3-6-17/h1-8,11-14,16,38H,9-10,15H2,(H3,32,33,34,35,36)
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n/an/a 0.990n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468320
PNG
(2-{3-[2-amino-6-(1,2,3,6- tetrahydropyridin-4-yl)-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCNCC1
Show InChI InChI=1S/C30H27FN6O2/c31-23-13-19(16-4-5-16)12-18-8-11-37(29(39)26(18)23)25-3-1-2-20(22(25)15-38)27-21-14-24(17-6-9-33-10-7-17)34-28(21)36-30(32)35-27/h1-3,6,8,11-14,16,33,38H,4-5,7,9-10,15H2,(H3,32,34,35,36)
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n/an/a 0.990n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465766
PNG
(2-(3-{2-amino-6-[4- (methylsulfonyl)phenyl]- 7H-py...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H26FN5O4S/c1-43(41,42)21-9-7-18(8-10-21)26-15-23-29(36-32(34)37-30(23)35-26)22-3-2-4-27(24(22)16-39)38-12-11-19-13-20(17-5-6-17)14-25(33)28(19)31(38)40/h2-4,7-15,17,39H,5-6,16H2,1H3,(H3,34,35,36,37)
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n/an/a 1.03n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465767
PNG
(2-{3-[2-amino-6-(6- fluoropyridin-2-yl)-7H- pyrrol...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1cccc(F)n1
Show InChI InChI=1S/C30H22F2N6O2/c31-21-12-17(15-7-8-15)11-16-9-10-38(29(40)26(16)21)24-5-1-3-18(20(24)14-39)27-19-13-23(22-4-2-6-25(32)34-22)35-28(19)37-30(33)36-27/h1-6,9-13,15,39H,7-8,14H2,(H3,33,35,36,37)
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n/an/a 1.06n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468319
PNG
(2-{3-[2-amino-6-(1- ethyl-1,2,3,6- tetrahydropyrid...)
Show SMILES CCN1CCC(=CC1)c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H31FN6O2/c1-2-38-11-8-19(9-12-38)26-16-23-29(36-32(34)37-30(23)35-26)22-4-3-5-27(24(22)17-40)39-13-10-20-14-21(18-6-7-18)15-25(33)28(20)31(39)41/h3-5,8,10,13-16,18,40H,2,6-7,9,11-12,17H2,1H3,(H3,34,35,36,37)
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n/an/a 1.10n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
btk (wt


(Homo sapiens (Human))
BDBM465768
PNG
(2-{3-[2-amino-6-(2- fluoropyridin-4-yl)-7H- pyrrol...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccnc(F)c1
Show InChI InChI=1S/C30H22F2N6O2/c31-22-11-18(15-4-5-15)10-17-7-9-38(29(40)26(17)22)24-3-1-2-19(21(24)14-39)27-20-13-23(16-6-8-34-25(32)12-16)35-28(20)37-30(33)36-27/h1-3,6-13,15,39H,4-5,14H2,(H3,33,35,36,37)
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n/an/a 1.11n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468317
PNG
(2-(3-{2-amino-6-[1- (pyrrolidine-1-carbonyl)- 1,2,...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCN(CC1)C(=O)N1CCCC1
Show InChI InChI=1S/C35H34FN7O3/c36-27-17-23(20-6-7-20)16-22-10-15-43(33(45)30(22)27)29-5-3-4-24(26(29)19-44)31-25-18-28(38-32(25)40-34(37)39-31)21-8-13-42(14-9-21)35(46)41-11-1-2-12-41/h3-5,8,10,15-18,20,44H,1-2,6-7,9,11-14,19H2,(H3,37,38,39,40)
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n/an/a 1.49n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM468306
PNG
(2-(3-{2-amino-6-[2- (methylamino)pyridin- 4-yl]-7H...)
Show SMILES CNc1cc(ccn1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C31H26FN7O2/c1-34-26-13-17(7-9-35-26)24-14-21-28(37-31(33)38-29(21)36-24)20-3-2-4-25(22(20)15-40)39-10-8-18-11-19(16-5-6-16)12-23(32)27(18)30(39)41/h2-4,7-14,16,40H,5-6,15H2,1H3,(H,34,35)(H3,33,36,37,38)
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n/an/a 1.60n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM465768
PNG
(2-{3-[2-amino-6-(2- fluoropyridin-4-yl)-7H- pyrrol...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccnc(F)c1
Show InChI InChI=1S/C30H22F2N6O2/c31-22-11-18(15-4-5-15)10-17-7-9-38(29(40)26(17)22)24-3-1-2-19(21(24)14-39)27-20-13-23(16-6-8-34-25(32)12-16)35-28(20)37-30(33)36-27/h1-3,6-13,15,39H,4-5,14H2,(H3,33,35,36,37)
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n/an/a 1.72n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK (C481S)


(Homo sapiens (Human))
BDBM50357312
PNG
(IBRUTINIB | PCI-32765 | US10124003, Ref. Ex. Compo...)
Show SMILES Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
Show InChI InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m1/s1
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n/an/a 5.80n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trademark) MSA (commercially available kit manufactured by Carna Biosciences, Inc...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465727
PNG
(2-[3-(2-amino-8-phenyl-9H-purin-6-yl)-2-(hydroxyme...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2nc([nH]c2n1)-c1ccccc1
Show InChI InChI=1S/C30H23FN6O2/c31-22-14-19(16-9-10-16)13-18-11-12-37(29(39)24(18)22)23-8-4-7-20(21(23)15-38)25-26-28(36-30(32)34-25)35-27(33-26)17-5-2-1-3-6-17/h1-8,11-14,16,38H,9-10,15H2,(H3,32,33,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465732
PNG
(2-[3-(2-amino-6-methyl- 7H-pyrrolo[2,3- d]pyrimidi...)
Show SMILES Cc1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C26H22FN5O2/c1-13-9-18-23(30-26(28)31-24(18)29-13)17-3-2-4-21(19(17)12-33)32-8-7-15-10-16(14-5-6-14)11-20(27)22(15)25(32)34/h2-4,7-11,14,33H,5-6,12H2,1H3,(H3,28,29,30,31)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465747
PNG
(2-{3-[6-amino-3-(3-methoxyphenyl)- 1H-pyrazolo[3,4...)
Show SMILES COc1cccc(c1)-c1n[nH]c2nc(N)nc(-c3cccc(c3CO)-n3ccc4cc(cc(F)c4c3=O)C3CC3)c12
Show InChI InChI=1S/C31H25FN6O3/c1-41-20-5-2-4-18(13-20)27-26-28(34-31(33)35-29(26)37-36-27)21-6-3-7-24(22(21)15-39)38-11-10-17-12-19(16-8-9-16)14-23(32)25(17)30(38)40/h2-7,10-14,16,39H,8-9,15H2,1H3,(H3,33,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465760
PNG
(2-{3-[2-amino-6- (2,4-difluorophenyl)- 7H-pyrrolo[...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(F)cc1F
Show InChI InChI=1S/C31H22F3N5O2/c32-18-6-7-20(23(33)12-18)25-13-21-28(37-31(35)38-29(21)36-25)19-2-1-3-26(22(19)14-40)39-9-8-16-10-17(15-4-5-15)11-24(34)27(16)30(39)41/h1-3,6-13,15,40H,4-5,14H2,(H3,35,36,37,38)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465731
PNG
(2-[3-(2-amino-7H-pyrrolo[2,3- d]pyrimidin-4-yl)-2-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc[nH]c2n1
Show InChI InChI=1S/C25H20FN5O2/c26-19-11-15(13-4-5-13)10-14-7-9-31(24(33)21(14)19)20-3-1-2-16(18(20)12-32)22-17-6-8-28-23(17)30-25(27)29-22/h1-3,6-11,13,32H,4-5,12H2,(H3,27,28,29,30)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465756
PNG
(2-{3-[2-amino-8- (1-methyl-1H-pyrazol- 4-yl)-9H-pu...)
Show SMILES Cn1cc(cn1)-c1nc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C28H23FN8O2/c1-36-12-17(11-31-36)25-32-24-23(33-28(30)35-26(24)34-25)18-3-2-4-21(19(18)13-38)37-8-7-15-9-16(14-5-6-14)10-20(29)22(15)27(37)39/h2-4,7-12,14,38H,5-6,13H2,1H3,(H3,30,32,33,34,35)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465741
PNG
(2-{3-[2-amino-6-(4-methoxyphenyl)- 7H-pyrrolo[2,3-...)
Show SMILES COc1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H26FN5O3/c1-41-21-9-7-18(8-10-21)26-15-23-29(36-32(34)37-30(23)35-26)22-3-2-4-27(24(22)16-39)38-12-11-19-13-20(17-5-6-17)14-25(33)28(19)31(38)40/h2-4,7-15,17,39H,5-6,16H2,1H3,(H3,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465757
PNG
(2-{3-[2-amino-6- (thiophen-3-yl)- 7H-pyrrolo[2,3- ...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccsc1
Show InChI InChI=1S/C29H22FN5O2S/c30-22-11-18(15-4-5-15)10-16-6-8-35(28(37)25(16)22)24-3-1-2-19(21(24)13-36)26-20-12-23(17-7-9-38-14-17)32-27(20)34-29(31)33-26/h1-3,6-12,14-15,36H,4-5,13H2,(H3,31,32,33,34)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465726
PNG
(2-[3-(2-amino-6-phenyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccccc1
Show InChI InChI=1S/C31H24FN5O2/c32-24-14-20(17-9-10-17)13-19-11-12-37(30(39)27(19)24)26-8-4-7-21(23(26)16-38)28-22-15-25(18-5-2-1-3-6-18)34-29(22)36-31(33)35-28/h1-8,11-15,17,38H,9-10,16H2,(H3,33,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465735
PNG
(2-[3-(6-amino-3-methyl-1H- pyrazolo[3,4-d]pyrimidi...)
Show SMILES Cc1n[nH]c2nc(N)nc(-c3cccc(c3CO)-n3ccc4cc(cc(F)c4c3=O)C3CC3)c12
Show InChI InChI=1S/C25H21FN6O2/c1-12-20-22(28-25(27)29-23(20)31-30-12)16-3-2-4-19(17(16)11-33)32-8-7-14-9-15(13-5-6-13)10-18(26)21(14)24(32)34/h2-4,7-10,13,33H,5-6,11H2,1H3,(H3,27,28,29,30,31)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465745
PNG
(2-{3-[6-amino-3-(4-methoxyphenyl)- 1H-pyrazolo[3,4...)
Show SMILES COc1ccc(cc1)-c1n[nH]c2nc(N)nc(-c3cccc(c3CO)-n3ccc4cc(cc(F)c4c3=O)C3CC3)c12
Show InChI InChI=1S/C31H25FN6O3/c1-41-20-9-7-17(8-10-20)27-26-28(34-31(33)35-29(26)37-36-27)21-3-2-4-24(22(21)15-39)38-12-11-18-13-19(16-5-6-16)14-23(32)25(18)30(38)40/h2-4,7-14,16,39H,5-6,15H2,1H3,(H3,33,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465751
PNG
(2-(3-{2-amino-6- [4-(morpholino- methyl)phenyl]-7H...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C36H33FN6O3/c37-29-17-25(22-8-9-22)16-24-10-11-43(35(45)32(24)29)31-3-1-2-26(28(31)20-44)33-27-18-30(39-34(27)41-36(38)40-33)23-6-4-21(5-7-23)19-42-12-14-46-15-13-42/h1-7,10-11,16-18,22,44H,8-9,12-15,19-20H2,(H3,38,39,40,41)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465752
PNG
(4-{2-amino-4-[3-(6- cyclopropyl-8-fluoro- 1-oxoiso...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(cc1)C#N
Show InChI InChI=1S/C32H23FN6O2/c33-25-13-21(18-8-9-18)12-20-10-11-39(31(41)28(20)25)27-3-1-2-22(24(27)16-40)29-23-14-26(36-30(23)38-32(35)37-29)19-6-4-17(15-34)5-7-19/h1-7,10-14,18,40H,8-9,16H2,(H3,35,36,37,38)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465753
PNG
(2-[3-(2-amino-5- phenyl-7H- pyrrolo[2,3-d]pyrimidi...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2c(c[nH]c2n1)-c1ccccc1
Show InChI InChI=1S/C31H24FN5O2/c32-24-14-20(17-9-10-17)13-19-11-12-37(30(39)26(19)24)25-8-4-7-21(23(25)16-38)28-27-22(18-5-2-1-3-6-18)15-34-29(27)36-31(33)35-28/h1-8,11-15,17,38H,9-10,16H2,(H3,33,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465765
PNG
(2-(3-{2-amino-6-[3- (trifIuoromethyl)phenyl]- 7H-p...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C32H23F4N5O2/c33-24-13-19(16-7-8-16)11-18-9-10-41(30(43)27(18)24)26-6-2-5-21(23(26)15-42)28-22-14-25(38-29(22)40-31(37)39-28)17-3-1-4-20(12-17)32(34,35)36/h1-6,9-14,16,42H,7-8,15H2,(H3,37,38,39,40)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465767
PNG
(2-{3-[2-amino-6-(6- fluoropyridin-2-yl)-7H- pyrrol...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1cccc(F)n1
Show InChI InChI=1S/C30H22F2N6O2/c31-21-12-17(15-7-8-15)11-16-9-10-38(29(40)26(16)21)24-5-1-3-18(20(24)14-39)27-19-13-23(22-4-2-6-25(32)34-22)35-28(19)37-30(33)36-27/h1-6,9-13,15,39H,7-8,14H2,(H3,33,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465728
PNG
(2-[3-(6-amino-3-phenyl-1H-pyrazolo[3,4-d]pyrimidin...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2c(n[nH]c2n1)-c1ccccc1
Show InChI InChI=1S/C30H23FN6O2/c31-22-14-19(16-9-10-16)13-18-11-12-37(29(39)24(18)22)23-8-4-7-20(21(23)15-38)27-25-26(17-5-2-1-3-6-17)35-36-28(25)34-30(32)33-27/h1-8,11-14,16,38H,9-10,15H2,(H3,32,33,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465761
PNG
(2-{3-[2-amino-6- (3,4-difluorophenyl)- 7H-pyrrolo[...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(F)c(F)c1
Show InChI InChI=1S/C31H22F3N5O2/c32-22-7-6-16(11-23(22)33)25-13-20-28(37-31(35)38-29(20)36-25)19-2-1-3-26(21(19)14-40)39-9-8-17-10-18(15-4-5-15)12-24(34)27(17)30(39)41/h1-3,6-13,15,40H,4-5,14H2,(H3,35,36,37,38)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465729
PNG
(2-[3-(2-amino-9H-purin-6-yl)-2- (hydroxymethyl)phe...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2nc[nH]c2n1
Show InChI InChI=1S/C24H19FN6O2/c25-17-9-14(12-4-5-12)8-13-6-7-31(23(33)19(13)17)18-3-1-2-15(16(18)10-32)20-21-22(28-11-27-21)30-24(26)29-20/h1-3,6-9,11-12,32H,4-5,10H2,(H3,26,27,28,29,30)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465730
PNG
(2-[3-(6-amino-1H-pyrazolo[3,4- d]pyrimidin-4-yl)-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cn[nH]c2n1
Show InChI InChI=1S/C24H19FN6O2/c25-18-9-14(12-4-5-12)8-13-6-7-31(23(33)20(13)18)19-3-1-2-15(17(19)11-32)21-16-10-27-30-22(16)29-24(26)28-21/h1-3,6-10,12,32H,4-5,11H2,(H3,26,27,28,29,30)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465733
PNG
(2-[3-(2-amino-6-{4-[(4-methylpiperazin- 1-yl)methy...)
Show SMILES CN1CCN(Cc2ccc(cc2)-c2cc3c(nc(N)nc3[nH]2)-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)CC1
Show InChI InChI=1S/C37H36FN7O2/c1-43-13-15-44(16-14-43)20-22-5-7-24(8-6-22)31-19-28-34(41-37(39)42-35(28)40-31)27-3-2-4-32(29(27)21-46)45-12-11-25-17-26(23-9-10-23)18-30(38)33(25)36(45)47/h2-8,11-12,17-19,23,46H,9-10,13-16,20-21H2,1H3,(H3,39,40,41,42)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465749
PNG
(2-{3-[2-amino-8-(2- methoxyphenyl)- 9H-purin-6-yl]...)
Show SMILES COc1ccccc1-c1nc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C31H25FN6O3/c1-41-24-8-3-2-5-20(24)28-34-27-26(35-31(33)37-29(27)36-28)19-6-4-7-23(21(19)15-39)38-12-11-17-13-18(16-9-10-16)14-22(32)25(17)30(38)40/h2-8,11-14,16,39H,9-10,15H2,1H3,(H3,33,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465766
PNG
(2-(3-{2-amino-6-[4- (methylsulfonyl)phenyl]- 7H-py...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H26FN5O4S/c1-43(41,42)21-9-7-18(8-10-21)26-15-23-29(36-32(34)37-30(23)35-26)22-3-2-4-27(24(22)16-39)38-12-11-19-13-20(17-5-6-17)14-25(33)28(19)31(38)40/h2-4,7-15,17,39H,5-6,16H2,1H3,(H3,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465737
PNG
(2-[3-(2-amino-8-cyclopropyl-9H-purin- 6-yl)-2-(hyd...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2nc([nH]c2n1)C1CC1
Show InChI InChI=1S/C27H23FN6O2/c28-19-11-16(13-4-5-13)10-15-8-9-34(26(36)21(15)19)20-3-1-2-17(18(20)12-35)22-23-25(33-27(29)31-22)32-24(30-23)14-6-7-14/h1-3,8-11,13-14,35H,4-7,12H2,(H3,29,30,31,32,33)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465738
PNG
(2-{3-[2-amino-6-(1-methyl-1H-pyrazol- 4-yl)-7H-pyr...)
Show SMILES Cn1cc(cn1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C29H24FN7O2/c1-36-13-18(12-32-36)23-11-20-26(34-29(31)35-27(20)33-23)19-3-2-4-24(21(19)14-38)37-8-7-16-9-17(15-5-6-15)10-22(30)25(16)28(37)39/h2-4,7-13,15,38H,5-6,14H2,1H3,(H3,31,33,34,35)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465739
PNG
(2-{3-[2-amino-6-(2-methoxyphenyl)- 7H-pyrrolo[2,3-...)
Show SMILES COc1ccccc1-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H26FN5O3/c1-41-27-8-3-2-5-21(27)25-15-22-29(36-32(34)37-30(22)35-25)20-6-4-7-26(23(20)16-39)38-12-11-18-13-19(17-9-10-17)14-24(33)28(18)31(38)40/h2-8,11-15,17,39H,9-10,16H2,1H3,(H3,34,35,36,37)
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n/an/a<10n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465746
PNG
(2-{3-[6-amino-3-(2-methoxyphenyl)- 1H-pyrazolo[3,4...)
Show SMILES COc1ccccc1-c1n[nH]c2nc(N)nc(-c3cccc(c3CO)-n3ccc4cc(cc(F)c4c3=O)C3CC3)c12
Show InChI InChI=1S/C31H25FN6O3/c1-41-24-8-3-2-5-20(24)28-26-27(34-31(33)35-29(26)37-36-28)19-6-4-7-23(21(19)15-39)38-12-11-17-13-18(16-9-10-16)14-22(32)25(17)30(38)40/h2-8,11-14,16,39H,9-10,15H2,1H3,(H3,33,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465748
PNG
(2-(3-{2-amino-6-[1-(oxetan-3-yl)-1,2,3,6-tetrahydr...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1=CCN(CC1)C1COC1
Show InChI InChI=1S/C33H31FN6O3/c34-26-13-21(18-4-5-18)12-20-8-11-40(32(42)29(20)26)28-3-1-2-23(25(28)15-41)30-24-14-27(36-31(24)38-33(35)37-30)19-6-9-39(10-7-19)22-16-43-17-22/h1-3,6,8,11-14,18,22,41H,4-5,7,9-10,15-17H2,(H3,35,36,37,38)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465734
PNG
(2-[3-(2-amino-6-cyclopropyl-7H- pyrrolo[2,3-d]pyri...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)C1CC1
Show InChI InChI=1S/C28H24FN5O2/c29-21-11-17(14-4-5-14)10-16-8-9-34(27(36)24(16)21)23-3-1-2-18(20(23)13-35)25-19-12-22(15-6-7-15)31-26(19)33-28(30)32-25/h1-3,8-12,14-15,35H,4-7,13H2,(H3,30,31,32,33)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465740
PNG
(2-{3-[2-amino-6-(3-methoxyphenyl)- 7H-pyrrolo[2,3-...)
Show SMILES COc1cccc(c1)-c1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C32H26FN5O3/c1-41-21-5-2-4-18(13-21)26-15-23-29(36-32(34)37-30(23)35-26)22-6-3-7-27(24(22)16-39)38-11-10-19-12-20(17-8-9-17)14-25(33)28(19)31(38)40/h2-7,10-15,17,39H,8-9,16H2,1H3,(H3,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465742
PNG
(2-{3-[2-amino-6-(pyridin-3-yl)-7H- pyrrolo[2,3-d]p...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1cccnc1
Show InChI InChI=1S/C30H23FN6O2/c31-23-12-19(16-6-7-16)11-17-8-10-37(29(39)26(17)23)25-5-1-4-20(22(25)15-38)27-21-13-24(18-3-2-9-33-14-18)34-28(21)36-30(32)35-27/h1-5,8-14,16,38H,6-7,15H2,(H3,32,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465743
PNG
(2-{3-[2-amino-8-(3-methoxyphenyl)- 9H-purin-6-yl]-...)
Show SMILES COc1cccc(c1)-c1nc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C31H25FN6O3/c1-41-20-5-2-4-18(13-20)28-34-27-26(35-31(33)37-29(27)36-28)21-6-3-7-24(22(21)15-39)38-11-10-17-12-19(16-8-9-16)14-23(32)25(17)30(38)40/h2-7,10-14,16,39H,8-9,15H2,1H3,(H3,33,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465744
PNG
(2-{3-[2-amino-6-(pyridin-4-yl)-7H- pyrrolo[2,3-d]p...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccncc1
Show InChI InChI=1S/C30H23FN6O2/c31-23-13-19(16-4-5-16)12-18-8-11-37(29(39)26(18)23)25-3-1-2-20(22(25)15-38)27-21-14-24(17-6-9-33-10-7-17)34-28(21)36-30(32)35-27/h1-3,6-14,16,38H,4-5,15H2,(H3,32,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465750
PNG
(2-{3-[2-amino-8- (pyridin-3-yl)- 9H-purin-6-yl]-2-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2nc([nH]c2n1)-c1cccnc1
Show InChI InChI=1S/C29H22FN7O2/c30-21-12-18(15-6-7-15)11-16-8-10-37(28(39)23(16)21)22-5-1-4-19(20(22)14-38)24-25-27(36-29(31)34-24)35-26(33-25)17-3-2-9-32-13-17/h1-5,8-13,15,38H,6-7,14H2,(H3,31,33,34,35,36)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465754
PNG
(2-{3-[2-amino-6- (3-fluorophenyl)- 7H-pyrrolo[2,3-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1cccc(F)c1
Show InChI InChI=1S/C31H23F2N5O2/c32-20-4-1-3-17(12-20)25-14-22-28(36-31(34)37-29(22)35-25)21-5-2-6-26(23(21)15-39)38-10-9-18-11-19(16-7-8-16)13-24(33)27(18)30(38)40/h1-6,9-14,16,39H,7-8,15H2,(H3,34,35,36,37)
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n/an/a<10n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465758
PNG
(2-{3-[2-amino-6- (2-fluorophenyl)- 7H-pyrrolo[2,3-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccccc1F
Show InChI InChI=1S/C31H23F2N5O2/c32-23-6-2-1-4-20(23)25-14-21-28(36-31(34)37-29(21)35-25)19-5-3-7-26(22(19)15-39)38-11-10-17-12-18(16-8-9-16)13-24(33)27(17)30(38)40/h1-7,10-14,16,39H,8-9,15H2,(H3,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465759
PNG
(2-{3-[2-amino-6- (4-fluorophenyl)- 7H-pyrrolo[2,3-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(F)cc1
Show InChI InChI=1S/C31H23F2N5O2/c32-20-8-6-17(7-9-20)25-14-22-28(36-31(34)37-29(22)35-25)21-2-1-3-26(23(21)15-39)38-11-10-18-12-19(16-4-5-16)13-24(33)27(18)30(38)40/h1-3,6-14,16,39H,4-5,15H2,(H3,34,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465762
PNG
(2-(3-{2-amino-6-[4- (trifIuoromethyl)phenyl]- 7H-p...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C32H23F4N5O2/c33-24-13-19(16-4-5-16)12-18-10-11-41(30(43)27(18)24)26-3-1-2-21(23(26)15-42)28-22-14-25(38-29(22)40-31(37)39-28)17-6-8-20(9-7-17)32(34,35)36/h1-3,6-14,16,42H,4-5,15H2,(H3,37,38,39,40)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465768
PNG
(2-{3-[2-amino-6-(2- fluoropyridin-4-yl)-7H- pyrrol...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccnc(F)c1
Show InChI InChI=1S/C30H22F2N6O2/c31-22-11-18(15-4-5-15)10-17-7-9-38(29(40)26(17)22)24-3-1-2-19(21(24)14-39)27-20-13-23(16-6-8-34-25(32)12-16)35-28(20)37-30(33)36-27/h1-3,6-13,15,39H,4-5,14H2,(H3,33,35,36,37)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465736
PNG
(2-{3-[2-amino-6-(hydroxymethyl)-7H- pyrrolo[2,3-d]...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc(CO)[nH]c2n1
Show InChI InChI=1S/C26H22FN5O3/c27-20-9-15(13-4-5-13)8-14-6-7-32(25(35)22(14)20)21-3-1-2-17(19(21)12-34)23-18-10-16(11-33)29-24(18)31-26(28)30-23/h1-3,6-10,13,33-34H,4-5,11-12H2,(H3,28,29,30,31)
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n/an/a 55n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465755
PNG
(N-({2-amino-4- [3-(6-cyclopropyl- 8-fluoro-1-oxois...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc(CNC(=O)C=C)[nH]c2n1
Show InChI InChI=1S/C29H25FN6O3/c1-2-24(38)32-13-18-12-20-26(34-29(31)35-27(20)33-18)19-4-3-5-23(21(19)14-37)36-9-8-16-10-17(15-6-7-15)11-22(30)25(16)28(36)39/h2-5,8-12,15,37H,1,6-7,13-14H2,(H,32,38)(H3,31,33,34,35)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465764
PNG
(2-{3-[2-amino-6- (aminomethyl)-7H- pyrrolo[2,3-d]p...)
Show SMILES NCc1cc2c(nc(N)nc2[nH]1)-c1cccc(c1CO)-n1ccc2cc(cc(F)c2c1=O)C1CC1
Show InChI InChI=1S/C26H23FN6O2/c27-20-9-15(13-4-5-13)8-14-6-7-33(25(35)22(14)20)21-3-1-2-17(19(21)12-34)23-18-10-16(11-28)30-24(18)32-26(29)31-23/h1-3,6-10,13,34H,4-5,11-12,28H2,(H3,29,30,31,32)
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CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase BTK


(Homo sapiens (Human))
BDBM465763
PNG
(2-(3-{2-amino-6-[4- (trifIuoromethoxy)phenyl]- 7H-...)
Show SMILES Nc1nc(-c2cccc(c2CO)-n2ccc3cc(cc(F)c3c2=O)C2CC2)c2cc([nH]c2n1)-c1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C32H23F4N5O3/c33-24-13-19(16-4-5-16)12-18-10-11-41(30(43)27(18)24)26-3-1-2-21(23(26)15-42)28-22-14-25(38-29(22)40-31(37)39-28)17-6-8-20(9-7-17)44-32(34,35)36/h1-3,6-14,16,42H,4-5,15H2,(H3,37,38,39,40)
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n/an/a 55n/an/an/an/an/an/a



CARNA BIOSCIENCES, INC.

US Patent


Assay Description
The kinase activity was measured using QuickScout Screening Assist (trade mark) MSA (commercially available kit manufactured by Carna Biosciences, In...


US Patent US10793575 (2020)

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