TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T66925 Coagulation factor XIIIA D0UR1H Peptide analog 54 Patented 71459385 C27H33ClN4O4 513 C=CC(=O)NCCCC[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2Cl)NC(=O)OCC3=CC=CC=C3 IC50 = 67000 nM Poor binder T66925 Coagulation factor XIIIA B2QH3D Tert-butyl 4-[4-[[(E)-2-methylbut-2-enoyl]amino]phenyl]sulfonylpiperazine-1-carboxylate Investigative 56954504 C20H29N3O5S 423.5 C/C=C(\\C)/C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA B32PHT Tert-butyl 2-[[(2S)-2-(phenylmethoxycarbonylamino)-6-(prop-2-enoylamino)hexanoyl]amino]acetate Investigative 71450343 C23H33N3O6 447.5 CC(C)(C)OC(=O)CNC(=O)[C@H](CCCCNC(=O)C=C)NC(=O)OCC1=CC=CC=C1 IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA B3Q0YV Methyl (2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[(E,2S)-6-methylsulfonyl-2-(phenylmethoxycarbonylamino)hex-5-enoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoate Investigative 58435684 C32H47N5O10S 693.8 CC(C)C[C@@H](C(=O)OC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC/C=C/S(=O)(=O)C)NC(=O)OCC2=CC=CC=C2 IC50 ~ 100000 nM Poor binder T66925 Coagulation factor XIIIA B6HR7O Tert-butyl 4-[4-[[(Z)-but-2-enoyl]amino]phenyl]sulfonylpiperazine-1-carboxylate Investigative 56954502 C19H27N3O5S 409.5 C/C=C\\C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA B93JXQ Tert-butyl 4-(4-cyanophenyl)sulfonylpiperazine-1-carboxylate Investigative 6736443 C16H21N3O4S 351.4 CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C#N IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA B9UR7J Ethyl (E,6S)-7-[[(2S)-5-amino-1-[(2S)-2-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1,5-dioxopentan-2-yl]amino]-7-oxo-6-(phenylmethoxycarbonylamino)hept-2-enoate Investigative 71096277 C34H49N5O10 687.8 CCOC(=O)/C=C/CC[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)OC)NC(=O)OCC2=CC=CC=C2 IC50 ~ 50000 nM Poor binder T66925 Coagulation factor XIIIA BAM17L (2S)-1-Acetyl-N-[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-methyl-1-oxopentan-2-yl]amino]-6-diazo-1,5-dioxohexan-2-yl]pyrrolidine-2-carboxamide Investigative 136233424 C33H46N8O7 666.8 CC(C)C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N)NC(=O)[C@H](CCC(=O)C=[N+]=[N-])NC(=O)[C@@H]3CCCN3C(=O)C IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA BJC4G6 Benzyl 4-[3-[methyl(2-methylpropyl)amino]-4-(prop-2-enoylamino)phenyl]sulfonylpiperazine-1-carboxylate Investigative 56954825 C26H34N4O5S 514.6 CC(C)CN(C)C1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)OCC3=CC=CC=C3)NC(=O)C=C IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA BJF9A1 (2S)-6-(1,3-Diethyl-4,5-dimethylimidazol-1-ium-2-yl)sulfanyl-5-oxo-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]hexanoic acid;bromide Investigative 72204898 C32H41BrN4O6S 689.7 CCN1C(=C([N+](=C1SCC(=O)CC[C@@H](C(=O)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)CC)C)C.[Br-] IC50 = 50000 nM Poor binder T66925 Coagulation factor XIIIA BMW1X7 Tert-butyl 4-[4-(2-methylprop-2-enoylamino)phenyl]sulfonylpiperazine-1-carboxylate Investigative 56954418 C19H27N3O5S 409.5 CC(=C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C IC50 ~ 80000 nM Poor binder T66925 Coagulation factor XIIIA BNX95R N-Hexyl-2-nitrobenzenesulfonamide Investigative 2836767 C12H18N2O4S 286.35 CCCCCCNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T66925 Coagulation factor XIIIA BOQ79Z [(5S)-5-Carboxy-2-oxo-5-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentyl]-dimethylsulfanium;bromide Investigative 11433027 C25H31BrN2O6S 567.5 C[S+](C)CC(=O)CC[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2.[Br-] IC50 = 105000 nM Poor binder T66925 Coagulation factor XIIIA BQC43P 2-Nitro-N-[6-(3-nitro-pyridin-2-ylamino)-hexyl]-benzenesulfonamide Investigative 11430157 C17H21N5O6S 423.4 C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NCCCCCCNC2=C(C=CC=N2)[N+](=O)[O-] IC50 = 170000 nM Poor binder T66925 Coagulation factor XIIIA BW3Y2M Ethyl (E,6S)-7-[[(2S)-1-[(2S)-2-[[(2S)-1-methoxy-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]amino]-7-oxo-6-(phenylmethoxycarbonylamino)hept-2-enoate Investigative 44177708 C34H50N4O9 658.8 CCOC(=O)/C=C/CC[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)OC)NC(=O)OCC2=CC=CC=C2 IC50 ~ 50000 nM Poor binder T66925 Coagulation factor XIIIA BZ8J1U Benzyl 4-[2-(prop-2-enoylamino)pyrimidin-5-yl]sulfonylpiperazine-1-carboxylate Investigative 56954413 C19H21N5O5S 431.5 C=CC(=O)NC1=NC=C(C=N1)S(=O)(=O)N2CCN(CC2)C(=O)OCC3=CC=CC=C3 IC50 ~ 80000 nM Poor binder