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Patent code US9988375

Compile Data Set for Download or QSAR
Found 36 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
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397464
PNG
(US9988375, Compound 43)
Show SMILES NCCCC[C@H](NC(=O)C1CCCC1)C(=O)COc1c(F)c(F)cc(F)c1F
Show InChI InChI=1S/C19H24F4N2O3/c20-12-9-13(21)17(23)18(16(12)22)28-10-15(26)14(7-3-4-8-24)25-19(27)11-5-1-2-6-11/h9,11,14H,1-8,10,24H2,(H,25,27)/t14-/m0/s1
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n/an/a<1n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397435
PNG
(US9988375, Compound 4)
Show SMILES NCCCC[C@H](NC(=O)[C@@H]1CCCN(C1)C(=O)CCc1ccccc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C28H34N4O3S/c29-17-7-6-13-23(26(34)28-31-22-12-4-5-14-24(22)36-28)30-27(35)21-11-8-18-32(19-21)25(33)16-15-20-9-2-1-3-10-20/h1-5,9-10,12,14,21,23H,6-8,11,13,15-19,29H2,(H,30,35)/t21-,23+/m1/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397443
PNG
(US9988375, Compound 14 | US9988375, Compound 15)
Show SMILES NCCCCC(NC(=O)c1cccn(c1)C(=O)CCc1ccccc1)C(=O)c1nc2ccccc2s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397438
PNG
(US9988375, Compound 9)
Show SMILES CC(=O)N1CCC[C@H](C1)C(=O)N[C@@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H28N4O3S/c1-14(26)25-12-6-7-15(13-25)20(28)23-17(9-4-5-11-22)19(27)21-24-16-8-2-3-10-18(16)29-21/h2-3,8,10,15,17H,4-7,9,11-13,22H2,1H3,(H,23,28)/t15-,17+/m1/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397440
PNG
(US9988375, Compound 11)
Show SMILES CC(=O)N1CCC[C@H](C1)C(=O)N[C@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H28N4O3S/c1-14(26)25-12-6-7-15(13-25)20(28)23-17(9-4-5-11-22)19(27)21-24-16-8-2-3-10-18(16)29-21/h2-3,8,10,15,17H,4-7,9,11-13,22H2,1H3,(H,23,28)/t15-,17-/m1/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397443
PNG
(US9988375, Compound 14 | US9988375, Compound 15)
Show SMILES NCCCCC(NC(=O)c1cccn(c1)C(=O)CCc1ccccc1)C(=O)c1nc2ccccc2s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397457
PNG
(US9988375, Compound 34)
Show SMILES NCCCC[C@@H](NC(=O)C1CCCO1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C18H23N3O3S/c19-10-4-3-7-13(20-17(23)14-8-5-11-24-14)16(22)18-21-12-6-1-2-9-15(12)25-18/h1-2,6,9,13-14H,3-5,7-8,10-11,19H2,(H,20,23)/t13-,14?/m1/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397455
PNG
(US9988375, Compound 32)
Show SMILES NCCCC[C@H](NC(=O)C1CCc2ccccc2C1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C24H27N3O2S/c25-14-6-5-10-20(22(28)24-27-19-9-3-4-11-21(19)30-24)26-23(29)18-13-12-16-7-1-2-8-17(16)15-18/h1-4,7-9,11,18,20H,5-6,10,12-15,25H2,(H,26,29)/t18?,20-/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397458
PNG
(US9988375, Compound 35)
Show SMILES NCCCC[C@H](NC(=O)C1CCCO1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C18H23N3O3S/c19-10-4-3-7-13(20-17(23)14-8-5-11-24-14)16(22)18-21-12-6-1-2-9-15(12)25-18/h1-2,6,9,13-14H,3-5,7-8,10-11,19H2,(H,20,23)/t13-,14?/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397456
PNG
(US9988375, Compound 33)
Show SMILES CC1(CCCCC1)C(=O)N[C@@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H29N3O2S/c1-21(12-6-2-7-13-21)20(26)24-16(10-5-8-14-22)18(25)19-23-15-9-3-4-11-17(15)27-19/h3-4,9,11,16H,2,5-8,10,12-14,22H2,1H3,(H,24,26)/t16-/m0/s1
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CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397433
PNG
(US9988375, Compound 2)
Show SMILES NCCCC[C@H](NC(=O)C1CCCCC1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C20H27N3O2S/c21-13-7-6-11-16(22-19(25)14-8-2-1-3-9-14)18(24)20-23-15-10-4-5-12-17(15)26-20/h4-5,10,12,14,16H,1-3,6-9,11,13,21H2,(H,22,25)/t16-/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397449
PNG
(US9988375, Compound 24)
Show SMILES NCCCC[C@H](NC(=O)C1CCCC1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H25N3O2S/c20-12-6-5-10-15(21-18(24)13-7-1-2-8-13)17(23)19-22-14-9-3-4-11-16(14)25-19/h3-4,9,11,13,15H,1-2,5-8,10,12,20H2,(H,21,24)/t15-/m0/s1
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n/an/a 5.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397433
PNG
(US9988375, Compound 2)
Show SMILES NCCCC[C@H](NC(=O)C1CCCCC1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C20H27N3O2S/c21-13-7-6-11-16(22-19(25)14-8-2-1-3-9-14)18(24)20-23-15-10-4-5-12-17(15)26-20/h4-5,10,12,14,16H,1-3,6-9,11,13,21H2,(H,22,25)/t16-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397446
PNG
(US9988375, Compound 19)
Show SMILES NCCCC[C@@H](NC(=O)C1CCCOC1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H25N3O3S/c20-10-4-3-8-15(21-18(24)13-6-5-11-25-12-13)17(23)19-22-14-7-1-2-9-16(14)26-19/h1-2,7,9,13,15H,3-6,8,10-12,20H2,(H,21,24)/t13?,15-/m1/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397445
PNG
(US9988375, Compound 18)
Show SMILES NCCCC[C@H](NC(=O)C1CCCOC1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H25N3O3S/c20-10-4-3-8-15(21-18(24)13-6-5-11-25-12-13)17(23)19-22-14-7-1-2-9-16(14)26-19/h1-2,7,9,13,15H,3-6,8,10-12,20H2,(H,21,24)/t13?,15-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397459
PNG
(US9988375, Compound 38)
Show SMILES NCCCC[C@H](NC(=O)c1cncs1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C17H18N4O2S2/c18-8-4-3-6-12(20-16(23)14-9-19-10-24-14)15(22)17-21-11-5-1-2-7-13(11)25-17/h1-2,5,7,9-10,12H,3-4,6,8,18H2,(H,20,23)/t12-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397454
PNG
(US9988375, Compound 31)
Show SMILES NCCCC[C@H](NC(=O)C1CCCc2ccccc12)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C24H27N3O2S/c25-15-6-5-13-20(22(28)24-27-19-12-3-4-14-21(19)30-24)26-23(29)18-11-7-9-16-8-1-2-10-17(16)18/h1-4,8,10,12,14,18,20H,5-7,9,11,13,15,25H2,(H,26,29)/t18?,20-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397437
PNG
(US9988375, Compound 8)
Show SMILES CC(=O)N1CCC[C@@H](C1)C(=O)N[C@@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H28N4O3S/c1-14(26)25-12-6-7-15(13-25)20(28)23-17(9-4-5-11-22)19(27)21-24-16-8-2-3-10-18(16)29-21/h2-3,8,10,15,17H,4-7,9,11-13,22H2,1H3,(H,23,28)/t15-,17-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397439
PNG
(US9988375, Compound 10)
Show SMILES CC(=O)N1CCC[C@@H](C1)C(=O)N[C@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H28N4O3S/c1-14(26)25-12-6-7-15(13-25)20(28)23-17(9-4-5-11-22)19(27)21-24-16-8-2-3-10-18(16)29-21/h2-3,8,10,15,17H,4-7,9,11-13,22H2,1H3,(H,23,28)/t15-,17+/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397434
PNG
(US9988375, Compound 3)
Show SMILES NCCCC[C@H](NC(=O)[C@H]1CCCN(C1)C(=O)CCc1ccccc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C28H34N4O3S/c29-17-7-6-13-23(26(34)28-31-22-12-4-5-14-24(22)36-28)30-27(35)21-11-8-18-32(19-21)25(33)16-15-20-9-2-1-3-10-20/h1-5,9-10,12,14,21,23H,6-8,11,13,15-19,29H2,(H,30,35)/t21-,23-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397452
PNG
(US9988375, Compound 29)
Show SMILES CC(=O)N1CCOC(C1)C(=O)N[C@@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C20H26N4O4S/c1-13(25)24-10-11-28-16(12-24)19(27)22-15(7-4-5-9-21)18(26)20-23-14-6-2-3-8-17(14)29-20/h2-3,6,8,15-16H,4-5,7,9-12,21H2,1H3,(H,22,27)/t15-,16?/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397447
PNG
(US9988375, Compound 22)
Show SMILES NCCCC[C@H](NC(=O)C1CCOCC1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H25N3O3S/c20-10-4-3-6-15(21-18(24)13-8-11-25-12-9-13)17(23)19-22-14-5-1-2-7-16(14)26-19/h1-2,5,7,13,15H,3-4,6,8-12,20H2,(H,21,24)/t15-/m0/s1
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n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397462
PNG
(US9988375, Compound 41)
Show SMILES COC1(CCCCC1)C(=O)N[C@@H](CCCCN)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H29N3O3S/c1-27-21(12-6-2-7-13-21)20(26)24-16(10-5-8-14-22)18(25)19-23-15-9-3-4-11-17(15)28-19/h3-4,9,11,16H,2,5-8,10,12-14,22H2,1H3,(H,24,26)/t16-/m0/s1
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US Patent
n/an/a 17.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397461
PNG
(US9988375, Compound 40)
Show SMILES NCCCC[C@H](NC(=O)c1cccc(=O)[nH]1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1/C19H20N4O3S/c20-11-4-3-7-13(22-18(26)14-8-5-10-16(24)21-14)17(25)19-23-12-6-1-2-9-15(12)27-19/h1-2,5-6,8-10,13H,3-4,7,11,20H2,(H,21,24)(H,22,26)/t13-/s2
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397436
PNG
(US9988375, Compound 7)
Show SMILES NCCCC[C@H](NC(=O)c1ccccc1C(F)(F)F)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H20F3N3O2S/c22-21(23,24)14-8-2-1-7-13(14)19(29)26-16(10-5-6-12-25)18(28)20-27-15-9-3-4-11-17(15)30-20/h1-4,7-9,11,16H,5-6,10,12,25H2,(H,26,29)/t16-/m0/s1
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397451
PNG
(US9988375, Compound 26)
Show SMILES NCCCCC(NC(=O)C1CCCCO1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H25N3O3S/c20-11-5-3-8-14(21-18(24)15-9-4-6-12-25-15)17(23)19-22-13-7-1-2-10-16(13)26-19/h1-2,7,10,14-15H,3-6,8-9,11-12,20H2,(H,21,24)
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397450
PNG
(US9988375, Compound 25)
Show SMILES NCCCC[C@H](NC(=O)C1CCCCO1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H25N3O3S/c20-11-5-3-8-14(21-18(24)15-9-4-6-12-25-15)17(23)19-22-13-7-1-2-10-16(13)26-19/h1-2,7,10,14-15H,3-6,8-9,11-12,20H2,(H,21,24)/t14-,15?/m0/s1
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397432
PNG
(US9988375, Compound 1)
Show SMILES NCCCC[C@H](NC(=O)c1ccccc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C20H21N3O2S/c21-13-7-6-11-16(22-19(25)14-8-2-1-3-9-14)18(24)20-23-15-10-4-5-12-17(15)26-20/h1-5,8-10,12,16H,6-7,11,13,21H2,(H,22,25)/t16-/m0/s1
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397453
PNG
(US9988375, Compound 30)
Show SMILES NCCCC[C@H](NC(=O)c1cccnc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H20N4O2S/c20-10-4-3-8-15(22-18(25)13-6-5-11-21-12-13)17(24)19-23-14-7-1-2-9-16(14)26-19/h1-2,5-7,9,11-12,15H,3-4,8,10,20H2,(H,22,25)/t15-/m0/s1
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397442
PNG
(US9988375, Compound 13)
Show SMILES NCCCC[C@H](NC(=O)c1ccncc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H20N4O2S/c20-10-4-3-6-15(22-18(25)13-8-11-21-12-9-13)17(24)19-23-14-5-1-2-7-16(14)26-19/h1-2,5,7-9,11-12,15H,3-4,6,10,20H2,(H,22,25)/t15-/m0/s1
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n/an/a 37.5n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397460
PNG
(US9988375, Compound 39)
Show SMILES NCCCC[C@H](NC(=O)c1nccs1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C17H18N4O2S2/c18-8-4-3-6-12(20-15(23)17-19-9-10-24-17)14(22)16-21-11-5-1-2-7-13(11)25-16/h1-2,5,7,9-10,12H,3-4,6,8,18H2,(H,20,23)/t12-/m0/s1
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CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397441
PNG
(US9988375, Compound 12)
Show SMILES NCCCC[C@H](NC(=O)c1ccccn1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H20N4O2S/c20-11-5-3-8-14(22-18(25)15-9-4-6-12-21-15)17(24)19-23-13-7-1-2-10-16(13)26-19/h1-2,4,6-7,9-10,12,14H,3,5,8,11,20H2,(H,22,25)/t14-/m0/s1
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CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397432
PNG
(US9988375, Compound 1)
Show SMILES NCCCC[C@H](NC(=O)c1ccccc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C20H21N3O2S/c21-13-7-6-11-16(22-19(25)14-8-2-1-3-9-14)18(24)20-23-15-10-4-5-12-17(15)26-20/h1-5,8-10,12,16H,6-7,11,13,21H2,(H,22,25)/t16-/m0/s1
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n/an/a 75n/an/an/an/an/an/a



CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397463
PNG
(US9988375, Compound 42)
Show SMILES NCCCC[C@H](NC(=O)C1CCCC1)C(=O)c1nccs1
Show InChI InChI=1S/C15H23N3O2S/c16-8-4-3-7-12(13(19)15-17-9-10-21-15)18-14(20)11-5-1-2-6-11/h9-12H,1-8,16H2,(H,18,20)/t12-/m0/s1
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CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM14297
PNG
(US9988375, Compound 23 | benzthiazole analog 1 | b...)
Show SMILES NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1/C21H23N3O3S/c22-13-7-6-11-17(24-21(26)27-14-15-8-2-1-3-9-15)19(25)20-23-16-10-4-5-12-18(16)28-20/h1-5,8-10,12,17H,6-7,11,13-14,22H2,(H,24,26)/t17-/s2
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US Patent
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CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

More data for this
Ligand-Target Pair
Lys-gingipain (kgp)


(Porphyromonas gingivalis)
BDBM397465
PNG
(N-[(1S)-5-amino-1-(pyridine-2-carbonyl)pentyl]cycl...)
Show SMILES NCCCC[C@H](NC(=O)C1CCCC1)NC(=O)c1cccnc1
Show InChI InChI=1S/C17H26N4O2/c18-10-4-3-9-15(20-16(22)13-6-1-2-7-13)21-17(23)14-8-5-11-19-12-14/h5,8,11-13,15H,1-4,6-7,9-10,18H2,(H,20,22)(H,21,23)/t15-/m1/s1
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CORTEXYME, INC.

US Patent


Assay Description
The specific assay conditions were as follows. Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions...


US Patent US9988375 (2018)

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