Compile Data Set for Download or QSAR
Found 118 of affinity data for UniProtKB/TrEMBL: B2RLK2
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553804(US11325884, Compound 1a-non-racemic | US11325884, ...)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H25F3N2O3/c20-13-8-9-14(21)18(17(13)22)27-11-16(25)15(7-3-4-10-23)24-19(26)12-5-1-2-6-12/h8-9,12,15H,1-7,10-11,23H2,(H,24,26)
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453289(US10730826, Compound 2a | US11325884, Compound 2a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H26F2N2O3/c20-14-8-5-9-15(21)18(14)26-12-17(24)16(10-3-4-11-22)23-19(25)13-6-1-2-7-13/h5,8-9,13,16H,1-4,6-7,10-12,22H2,(H,23,25)
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553804(US11325884, Compound 1a-non-racemic | US11325884, ...)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H25F3N2O3/c20-13-8-9-14(21)18(17(13)22)27-11-16(25)15(7-3-4-10-23)24-19(26)12-5-1-2-6-12/h8-9,12,15H,1-7,10-11,23H2,(H,24,26)
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453275(US10730826, Compound 1a-non-racemic | US10730826, ...)
Show SMILES NCCCC[C@H](NC(=O)C1CCCC1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H25F3N2O3/c20-13-8-9-14(21)18(17(13)22)27-11-16(25)15(7-3-4-10-23)24-19(26)12-5-1-2-6-12/h8-9,12,15H,1-7,10-11,23H2,(H,24,26)/t15-/m0/s1
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM397464(US10676470, Compound 43 | US10730826, Compound 73 ...)
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
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553828(US11325884, Compound 74)
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-/m1/s1
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM397464(US10676470, Compound 43 | US10730826, Compound 73 ...)
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
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM397464(US10676470, Compound 43 | US10730826, Compound 73 ...)
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
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453289(US10730826, Compound 2a | US11325884, Compound 2a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H26F2N2O3/c20-14-8-5-9-15(21)18(14)26-12-17(24)16(10-3-4-11-22)23-19(25)13-6-1-2-7-13/h5,8-9,13,16H,1-4,6-7,10-12,22H2,(H,23,25)
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453289(US10730826, Compound 2a | US11325884, Compound 2a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H26F2N2O3/c20-14-8-5-9-15(21)18(14)26-12-17(24)16(10-3-4-11-22)23-19(25)13-6-1-2-7-13/h5,8-9,13,16H,1-4,6-7,10-12,22H2,(H,23,25)
Affinity DataIC50: 0.0500nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553862(US11325884, Compound 52a)
Show SMILES NCCCCC(NC(=O)c1ccncc1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H20F3N3O3/c20-13-4-5-14(21)18(17(13)22)28-11-16(26)15(3-1-2-8-23)25-19(27)12-6-9-24-10-7-12/h4-7,9-10,15H,1-3,8,11,23H2,(H,25,27)
Affinity DataIC50: 0.0600nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553832(US11325884, Compound 47a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C18H25F3N2O4/c1-18(2,26-3)17(25)23-13(6-4-5-9-22)14(24)10-27-16-12(20)8-7-11(19)15(16)21/h7-8,13H,4-6,9-10,22H2,1-3H3,(H,23,25)
Affinity DataIC50: 0.0600nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553856(US11325884, Compound 42a)
Show SMILES NCCCCC(NC(=O)c1cccnc1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H20F3N3O3/c20-13-6-7-14(21)18(17(13)22)28-11-16(26)15(5-1-2-8-23)25-19(27)12-4-3-9-24-10-12/h3-4,6-7,9-10,15H,1-2,5,8,11,23H2,(H,25,27)
Affinity DataIC50: 0.0600nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453293(US10730826, Compound 4a | US11325884, Compound 4a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1cc(F)cc(F)c1F
Show InChI InChI=1S/C19H25F3N2O3/c20-13-9-14(21)18(22)17(10-13)27-11-16(25)15(7-3-4-8-23)24-19(26)12-5-1-2-6-12/h9-10,12,15H,1-8,11,23H2,(H,24,26)
Affinity DataIC50: 0.0700nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553836(US11325884, Compound 48a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C18H26F2N2O4/c1-18(2,25-3)17(24)22-14(9-4-5-10-21)15(23)11-26-16-12(19)7-6-8-13(16)20/h6-8,14H,4-5,9-11,21H2,1-3H3,(H,22,24)
Affinity DataIC50: 0.0700nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553818(US11325884, Compound 12a | US11325884, Compound 33...)
Show SMILES NCCCCC(NC(=O)c1cccc(c1)N=[N+]=[N-])C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C20H21F2N5O3/c21-15-7-4-8-16(22)19(15)30-12-18(28)17(9-1-2-10-23)25-20(29)13-5-3-6-14(11-13)26-27-24/h3-8,11,17H,1-2,9-10,12,23H2,(H,25,29)
Affinity DataIC50: 0.0800nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553845(US11325884, Compound 32a)
Show SMILES NCCCCC(NC(=O)c1cccnc1F)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H20F3N3O3/c20-13-6-3-7-14(21)17(13)28-11-16(26)15(8-1-2-9-23)25-19(27)12-5-4-10-24-18(12)22/h3-7,10,15H,1-2,8-9,11,23H2,(H,25,27)
Affinity DataIC50: 0.0800nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453309(US10730826, Compound 10a | US10730826, Compound 9a...)
Show SMILES CC(=O)Nc1cccc(c1)C(=O)NC(CCCCN)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C22H25F2N3O4/c1-14(28)26-16-7-4-6-15(12-16)22(30)27-19(10-2-3-11-25)20(29)13-31-21-17(23)8-5-9-18(21)24/h4-9,12,19H,2-3,10-11,13,25H2,1H3,(H,26,28)(H,27,30)
Affinity DataIC50: 0.0800nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553818(US11325884, Compound 12a | US11325884, Compound 33...)
Show SMILES NCCCCC(NC(=O)c1cccc(c1)N=[N+]=[N-])C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C20H21F2N5O3/c21-15-7-4-8-16(22)19(15)30-12-18(28)17(9-1-2-10-23)25-20(29)13-5-3-6-14(11-13)26-27-24/h3-8,11,17H,1-2,9-10,12,23H2,(H,25,29)
Affinity DataIC50: 0.0800nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553831(US11325884, Compound 21)
Show SMILES NCCCC[C@@H](NC(=O)C1CCCC1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H25F3N2O3/c20-13-8-9-14(21)18(17(13)22)27-11-16(25)15(7-3-4-10-23)24-19(26)12-5-1-2-6-12/h8-9,12,15H,1-7,10-11,23H2,(H,24,26)/t15-/m1/s1
Affinity DataIC50: 0.0900nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553833(US11325884, Compound 50a)
Show SMILES NCCCCC(NC(=O)c1ccccn1)C(=O)COc1c(F)ccc(F)c1F
Show InChI InChI=1S/C19H20F3N3O3/c20-12-7-8-13(21)18(17(12)22)28-11-16(26)14(5-1-3-9-23)25-19(27)15-6-2-4-10-24-15/h2,4,6-8,10,14H,1,3,5,9,11,23H2,(H,25,27)
Affinity DataIC50: 0.0900nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553857(US11325884, Compound 43a)
Show SMILES NCCCCC(NC(=O)c1cccnc1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H21F2N3O3/c20-14-6-3-7-15(21)18(14)27-12-17(25)16(8-1-2-9-22)24-19(26)13-5-4-10-23-11-13/h3-7,10-11,16H,1-2,8-9,12,22H2,(H,24,26)
Affinity DataIC50: 0.0900nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553871(US11325884, Compound 63a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COc1cc(C)nc(C)c1
Show InChI InChI=1S/C19H31N3O4/c1-13-10-15(11-14(2)21-13)26-12-17(23)16(8-6-7-9-20)22-18(24)19(3,4)25-5/h10-11,16H,6-9,12,20H2,1-5H3,(H,22,24)
Affinity DataIC50: 0.0900nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553839(US11325884, Compound 26a)
Show SMILES NCCCCC(NC(=O)c1cccc(F)c1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C20H21F3N2O3/c21-14-6-3-5-13(11-14)20(27)25-17(9-1-2-10-24)18(26)12-28-19-15(22)7-4-8-16(19)23/h3-8,11,17H,1-2,9-10,12,24H2,(H,25,27)
Affinity DataIC50: 0.0900nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553838(US11325884, Compound 57a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COc1ccon1
Show InChI InChI=1S/C15H25N3O5/c1-15(2,21-3)14(20)17-11(6-4-5-8-16)12(19)10-22-13-7-9-23-18-13/h7,9,11H,4-6,8,10,16H2,1-3H3,(H,17,20)
Affinity DataIC50: 0.0900nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553865(US11325884, Compound 56a)
Show SMILES NCCCCC(NC(=O)c1cccnc1F)C(=O)COc1ccon1
Show InChI InChI=1S/C16H19FN4O4/c17-15-11(4-3-8-19-15)16(23)20-12(5-1-2-7-18)13(22)10-24-14-6-9-25-21-14/h3-4,6,8-9,12H,1-2,5,7,10,18H2,(H,20,23)
Affinity DataIC50: 0.100nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553848(US11325884, Compound 35a)
Show SMILES NCCCCC(NC(=O)c1ccc(F)cc1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C20H21F3N2O3/c21-14-9-7-13(8-10-14)20(27)25-17(6-1-2-11-24)18(26)12-28-19-15(22)4-3-5-16(19)23/h3-5,7-10,17H,1-2,6,11-12,24H2,(H,25,27)
Affinity DataIC50: 0.100nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553834(US11325884, Compound 55a)
Show SMILES NCCCCC(NC(=O)c1ccc(F)nc1)C(=O)COc1ccon1
Show InChI InChI=1S/C16H19FN4O4/c17-14-5-4-11(9-19-14)16(23)20-12(3-1-2-7-18)13(22)10-24-15-6-8-25-21-15/h4-6,8-9,12H,1-3,7,10,18H2,(H,20,23)
Affinity DataIC50: 0.120nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453309(US10730826, Compound 10a | US10730826, Compound 9a...)
Show SMILES CC(=O)Nc1cccc(c1)C(=O)NC(CCCCN)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C22H25F2N3O4/c1-14(28)26-16-7-4-6-15(12-16)22(30)27-19(10-2-3-11-25)20(29)13-31-21-17(23)8-5-9-18(21)24/h4-9,12,19H,2-3,10-11,13,25H2,1H3,(H,26,28)(H,27,30)
Affinity DataIC50: 0.120nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553847(US11325884, Compound 34a)
Show SMILES NCCCCC(NC(=O)c1cccnc1Br)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H20BrF2N3O3/c20-18-12(5-4-10-24-18)19(27)25-15(8-1-2-9-23)16(26)11-28-17-13(21)6-3-7-14(17)22/h3-7,10,15H,1-2,8-9,11,23H2,(H,25,27)
Affinity DataIC50: 0.130nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553870(US11325884, Compound 62a)
Show SMILES CN(C)c1ccc(cn1)C(=O)NC(CCCCN)C(=O)COc1ccon1
Show InChI InChI=1S/C18H25N5O4/c1-23(2)16-7-6-13(11-20-16)18(25)21-14(5-3-4-9-19)15(24)12-26-17-8-10-27-22-17/h6-8,10-11,14H,3-5,9,12,19H2,1-2H3,(H,21,25)
Affinity DataIC50: 0.140nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453305(US10730826, Compound 5a | US11325884, Compound 5a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1cccc(F)c1F
Show InChI InChI=1S/C19H26F2N2O3/c20-14-8-5-10-17(18(14)21)26-12-16(24)15(9-3-4-11-22)23-19(25)13-6-1-2-7-13/h5,8,10,13,15H,1-4,6-7,9,11-12,22H2,(H,23,25)
Affinity DataIC50: 0.150nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553844(US11325884, Compound 31a)
Show SMILES NCCCCC(NC(=O)c1ccnc(F)c1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H20F3N3O3/c20-13-4-3-5-14(21)18(13)28-11-16(26)15(6-1-2-8-23)25-19(27)12-7-9-24-17(22)10-12/h3-5,7,9-10,15H,1-2,6,8,11,23H2,(H,25,27)
Affinity DataIC50: 0.150nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553873(US11325884, Compound 65a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COc1cnc(C)nc1
Show InChI InChI=1S/C17H28N4O4/c1-12-19-9-13(10-20-12)25-11-15(22)14(7-5-6-8-18)21-16(23)17(2,3)24-4/h9-10,14H,5-8,11,18H2,1-4H3,(H,21,23)
Affinity DataIC50: 0.160nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453306(US10730826, Compound 6a | US11325884, Compound 6a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1cc(F)ccc1F
Show InChI InChI=1S/C19H26F2N2O3/c20-14-8-9-15(21)18(11-14)26-12-17(24)16(7-3-4-10-22)23-19(25)13-5-1-2-6-13/h8-9,11,13,16H,1-7,10,12,22H2,(H,23,25)
Affinity DataIC50: 0.190nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553835(US11325884, Compound 69a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C15H24F6N2O4/c1-13(2,26-3)12(25)23-9(6-4-5-7-22)10(24)8-27-11(14(16,17)18)15(19,20)21/h9,11H,4-8,22H2,1-3H3,(H,23,25)
Affinity DataIC50: 0.210nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553843(US11325884, Compound 30a)
Show SMILES NCCCCC(NC(=O)c1cccc(OCCCF)c1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C23H27F3N2O4/c24-11-5-13-31-17-7-3-6-16(14-17)23(30)28-20(10-1-2-12-27)21(29)15-32-22-18(25)8-4-9-19(22)26/h3-4,6-9,14,20H,1-2,5,10-13,15,27H2,(H,28,30)
Affinity DataIC50: 0.210nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553837(US11325884, Compound 49a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1ccon1
Show InChI InChI=1S/C16H25N3O4/c17-9-4-3-7-13(18-16(21)12-5-1-2-6-12)14(20)11-22-15-8-10-23-19-15/h8,10,12-13H,1-7,9,11,17H2,(H,18,21)
Affinity DataIC50: 0.230nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553840(US11325884, Compound 27a)
Show SMILES NCCCCC(NC(=O)c1cccc(OCCF)c1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C22H25F3N2O4/c23-10-12-30-16-6-3-5-15(13-16)22(29)27-19(9-1-2-11-26)20(28)14-31-21-17(24)7-4-8-18(21)25/h3-8,13,19H,1-2,9-12,14,26H2,(H,27,29)
Affinity DataIC50: 0.270nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553842(US11325884, Compound 29a)
Show SMILES NCCCCC(NC(=O)c1ccc(F)nc1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H20F3N3O3/c20-13-4-3-5-14(21)18(13)28-11-16(26)15(6-1-2-9-23)25-19(27)12-7-8-17(22)24-10-12/h3-5,7-8,10,15H,1-2,6,9,11,23H2,(H,25,27)
Affinity DataIC50: 0.310nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553841(US11325884, Compound 28a)
Show SMILES NCCCCC(NC(=O)c1cccc(F)n1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C19H20F3N3O3/c20-12-5-3-6-13(21)18(12)28-11-16(26)14(7-1-2-10-23)25-19(27)15-8-4-9-17(22)24-15/h3-6,8-9,14H,1-2,7,10-11,23H2,(H,25,27)
Affinity DataIC50: 0.340nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453308(US10730826, Compound 8a | US11325884, Compound 8a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1cc(F)cc(F)c1
Show InChI InChI=1S/C19H26F2N2O3/c20-14-9-15(21)11-16(10-14)26-12-18(24)17(7-3-4-8-22)23-19(25)13-5-1-2-6-13/h9-11,13,17H,1-8,12,22H2,(H,23,25)
Affinity DataIC50: 0.340nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553872(US11325884, Compound 64a)
Show SMILES COC(C)(C)C(=O)NC(CCCCN)C(=O)COc1cccnc1
Show InChI InChI=1S/C17H27N3O4/c1-17(2,23-3)16(22)20-14(8-4-5-9-18)15(21)12-24-13-7-6-10-19-11-13/h6-7,10-11,14H,4-5,8-9,12,18H2,1-3H3,(H,20,22)
Affinity DataIC50: 0.400nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553861(US11325884, Compound 51a)
Show SMILES NCCCCC(NC(=O)c1cccc(c1)-n1cc(CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)nn1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C33H40F2N8O5S/c34-23-9-6-10-24(35)31(23)48-18-27(44)25(11-3-4-14-36)38-32(46)20-7-5-8-22(15-20)43-17-21(41-42-43)16-37-29(45)13-2-1-12-28-30-26(19-49-28)39-33(47)40-30/h5-10,15,17,25-26,28,30H,1-4,11-14,16,18-19,36H2,(H,37,45)(H,38,46)(H2,39,40,47)/t25?,26-,28-,30-/m0/s1
Affinity DataIC50: 0.400nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553869(US11325884, Compound 61a)
Show SMILES C[N+](C)(C)c1ccc(cn1)C(=O)NC(CCCCN)C(=O)COc1ccon1
Show InChI InChI=1S/C19H27N5O4/c1-24(2,3)17-8-7-14(12-21-17)19(26)22-15(6-4-5-10-20)16(25)13-27-18-9-11-28-23-18/h7-9,11-12,15H,4-6,10,13,20H2,1-3H3/p+1
Affinity DataIC50: 0.430nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553861(US11325884, Compound 51a)
Show SMILES NCCCCC(NC(=O)c1cccc(c1)-n1cc(CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)nn1)C(=O)COc1c(F)cccc1F
Show InChI InChI=1S/C33H40F2N8O5S/c34-23-9-6-10-24(35)31(23)48-18-27(44)25(11-3-4-14-36)38-32(46)20-7-5-8-22(15-20)43-17-21(41-42-43)16-37-29(45)13-2-1-12-28-30-26(19-49-28)39-33(47)40-30/h5-10,15,17,25-26,28,30H,1-4,11-14,16,18-19,36H2,(H,37,45)(H,38,46)(H2,39,40,47)/t25?,26-,28-,30-/m0/s1
Affinity DataIC50: 0.440nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553824(US11325884, Compound 18a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C16H24F6N2O3/c17-15(18,19)14(16(20,21)22)27-9-12(25)11(7-3-4-8-23)24-13(26)10-5-1-2-6-10/h10-11,14H,1-9,23H2,(H,24,26)
Affinity DataIC50: 0.5nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM553824(US11325884, Compound 18a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COC(C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C16H24F6N2O3/c17-15(18,19)14(16(20,21)22)27-9-12(25)11(7-3-4-8-23)24-13(26)10-5-1-2-6-10/h10-11,14H,1-9,23H2,(H,24,26)
Affinity DataIC50: 0.5nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM453290(US10730826, Compound 3a | US11325884, Compound 3a)
Show SMILES NCCCCC(NC(=O)C1CCCC1)C(=O)COc1ccccc1F
Show InChI InChI=1S/C19H27FN2O3/c20-15-9-3-4-11-18(15)25-13-17(23)16(10-5-6-12-21)22-19(24)14-7-1-2-8-14/h3-4,9,11,14,16H,1-2,5-8,10,12-13,21H2,(H,22,24)
Affinity DataIC50: 0.640nMAssay Description:The capacities of compounds of the present invention to inhibit the activity of lysine gingipain (Kgp) were measured in a fluorogenic assay similar t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLys-gingipain(Porphyromonas gingivalis)
CORTEXYME, INC.

US Patent
LigandPNGBDBM397464(US10676470, Compound 43 | US10730826, Compound 73 ...)
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
Affinity DataIC50: 1nMAssay Description:Buffer: pH=7.5, 100 mM Tris-HCl, 75 mM NaCl, 2.5 mM CaCl2, 10 mM cysteine, 1% DMSO after all additions. Protein: 0.1 nM Kgp, isolated from culture of...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
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