TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T27602	Cationic trypsinogen	B01FBT	{1-[1-(4-Amino-1-formyl-butylcarbamoyl)-3-methyl-butylcarbamoyl]-2-phenyl-ethyl}-carbamic acid benzyl ester	Investigative	14488976	C28H38N4O5	510.6	CC(C)C[C@@H](C(=O)N[C@@H](CCCN)C=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	B0HYS4	2-[3-(2,2-Difluoro-2-pyridin-2-yl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-pyridin-2-ylmethyl-acetamide	Investigative	11811735	C20H20F2N6O2	414.4	CC1=CN=C(C(=O)N1CC(=O)NCC2=CC=CC=N2)NCC(C3=CC=CC=N3)(F)F	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B0LW9B	2-[6-Chloro-3-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-N-(3-chloro-pyridin-2-ylmethyl)-acetamide	Investigative	10863633	C19H16Cl2F2N6O2	469.3	C1=CC=NC(=C1)C(CNC2=NC=C(N(C2=O)CC(=O)NCC3=C(C=CC=N3)Cl)Cl)(F)F	Ki = 567000 nM	Non binder
T27602	Cationic trypsinogen	B0M8CX	1beta,5beta-Bis[4-[4alpha-(aminomethyl)cyclohexane-1beta-ylmethylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	44315644	C36H64N8O6	704.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCC3CCC(CC3)CN)OC(=O)N4CCN(CC4)C(=O)NCC5CCC(CC5)CN	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B16VHR	2-(6-Chloro-3-{[2,2-difluoro-2-(2-pyridinyl)ethyl]amino}-2-oxo-1(2H)-pyrazinyl)-N-[(2-fluoro-6-pyridinyl)methyl]acetamide	Investigative	447219	C20H19F3N6O2	432.4	CC1=CN=C(C(=O)N1CC(=O)NCC2=C(C=CC=N2)F)NCC(C3=CC=CC=N3)(F)F	Ki = 252000 nM	Non binder
T27602	Cationic trypsinogen	B1AZX5	1,4-Bis[1,4-dioxo-4-[methyl[4-(aminomethyl)benzyl]amino]butylaminomethyl]benzene	Investigative	44315609	C34H44N6O4	600.8	CN(CC1=CC=C(C=C1)CN)C(=O)CCC(=O)NCC2=CC=C(C=C2)CNC(=O)CCC(=O)N(C)CC3=CC=C(C=C3)CN	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B1CR2E	1beta,5beta-Bis[4-[3-(4-guanidinophenyl)propionyl]piperazinocarbonyloxy]cyclooctane	Investigative	18397347	C38H54N10O6	746.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)N=C(N)N)OC(=O)N4CCN(CC4)C(=O)CCC5=CC=C(C=C5)N=C(N)N	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B1DC9U	4-Aminobenzylamine	Investigative	427814	C7H10N2	122.17	C1=CC(=CC=C1CN)N	Ki = 500034535 nM	Non binder
T27602	Cationic trypsinogen	B1FYN7	1,4-Bis[1,5-dioxo-5-[4-(aminomethyl)benzylamino]pentylaminomethyl]benzene	Investigative	44315849	C34H44N6O4	600.8	C1=CC(=CC=C1CN)CNC(=O)CCCC(=O)NCC2=CC=C(C=C2)CNC(=O)CCCC(=O)NCC3=CC=C(C=C3)CN	Ki = 274000 nM	Non binder
T27602	Cationic trypsinogen	B20QPI	(2S)-1-[(2R)-2-Amino-3,3-diphenylpropanoyl]-N-[(2-amino-5,6,7,8-tetrahydroquinazolin-6-yl)methyl]pyrrolidine-2-carboxamide	Investigative	44378546	C29H34N6O2	498.6	C1C[C@H](N(C1)C(=O)[C@@H](C(C2=CC=CC=C2)C3=CC=CC=C3)N)C(=O)NCC4CCC5=NC(=NC=C5C4)N	Ki = 409000 nM	Non binder
T27602	Cationic trypsinogen	B21SKZ	{1-[1-(5-Amino-1-formyl-pentylcarbamoyl)-3-methyl-butylcarbamoyl]-2-phenyl-ethyl}-carbamic acid benzyl ester	Investigative	14488968	C29H40N4O5	524.7	CC(C)C[C@@H](C(=O)N[C@@H](CCCCN)C=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	B23IDV	2-[3-(2,2-Difluoro-2-phenyl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-(3-fluoro-pyridin-2-ylmethyl)-acetamide	Investigative	11026399	C21H20F3N5O2	431.4	CC1=CN=C(C(=O)N1CC(=O)NCC2=C(C=CC=N2)F)NCC(C3=CC=CC=C3)(F)F	Ki = 501000 nM	Non binder
T27602	Cationic trypsinogen	B29BFV	4-(Aminomethyl)-N-phenylbenzamide	Investigative	16776143	C14H14N2O	226.27	C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN	Ki = 199986187 nM	Non binder
T27602	Cationic trypsinogen	B2HL5B	(4-Chlorophenyl)methyl 4-(aminomethyl)benzoate	Investigative	44365721	C15H14ClNO2	275.73	C1=CC(=CC=C1CN)C(=O)OCC2=CC=C(C=C2)Cl	Ki = 29991625.19 nM	Non binder
T27602	Cationic trypsinogen	B2PWM4	4-(Aminomethyl)benzamide	Investigative	2512818	C8H10N2O	150.18	C1=CC(=CC=C1CN)C(=O)N	Ki = 399944749.8 nM	Non binder
T27602	Cationic trypsinogen	B3CY5U	[5-[4-[2-[4-(2-Aminoethyl)phenyl]ethylcarbamoyl]piperazine-1-carbonyl]oxycyclooctyl] 4-[2-[4-(2-aminoethyl)phenyl]ethylcarbamoyl]piperazine-1-carboxylate	Investigative	44315914	C40H60N8O6	749	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)CCN)OC(=O)N4CCN(CC4)C(=O)NCCC5=CC=C(C=C5)CCN	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B3TQK0	2-[4-[5-[4-(4,5-Dihydro-1H-imidazol-2-yl)phenoxy]pentoxy]phenyl]-4,5-dihydro-1H-imidazole;hydrochloride	Investigative	44573519	C23H29ClN4O2	429	C1CN=C(N1)C2=CC=C(C=C2)OCCCCCOC3=CC=C(C=C3)C4=NCCN4.Cl	Ki > 2000000 nM	Non binder
T27602	Cationic trypsinogen	B3VO6J	4-Aminomethyl-benzoic acid pentyl ester	Investigative	44365694	C13H19NO2	221.29	CCCCCOC(=O)C1=CC=C(C=C1)CN	Ki = 699841996 nM	Non binder
T27602	Cationic trypsinogen	B43XWY	2-[3-(2,2-Difluoro-2-phenyl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-(4-methyl-pyridin-2-ylmethyl)-acetamide	Investigative	10895218	C22H23F2N5O2	427.4	CC1=CC(=NC=C1)CNC(=O)CN2C(=CN=C(C2=O)NCC(C3=CC=CC=C3)(F)F)C	Ki = 270000 nM	Non binder
T27602	Cationic trypsinogen	B4U2LW	3-[Bis(6-aminohexyl)amino]tetrahydro-4H-thiopyran-4-one	Investigative	10664145	C17H35N3OS	329.5	C1CSCC(C1=O)N(CCCCCCN)CCCCCCN	Ki = 1400000 nM	Non binder
T27602	Cationic trypsinogen	B54ZMF	4-Aminomethyl-benzoic acid phenethyl ester	Investigative	44365669	C16H17NO2	255.31	C1=CC=C(C=C1)CCOC(=O)C2=CC=C(C=C2)CN	Ki = 599791076.3 nM	Non binder
T27602	Cationic trypsinogen	B6B8LD	4-(Aminomethyl)-N-benzylbenzamide	Investigative	20113118	C15H16N2O	240.3	C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN	Ki = 399944749.8 nM	Non binder
T27602	Cationic trypsinogen	B6MWG7	1beta,5beta-Bis[4-[4-(aminomethyl)benzylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	18397354	C36H52N8O6	692.8	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)CN)OC(=O)N4CCN(CC4)C(=O)NCC5=CC=C(C=C5)CN	Ki = 219000 nM	Non binder
T27602	Cationic trypsinogen	B6O3KR	1,4-Bis[1,4-dioxo-4-[4-(aminomethyl)benzylamino]butylaminomethyl]benzene	Investigative	44315607	C32H40N6O4	572.7	C1=CC(=CC=C1CN)CNC(=O)CCC(=O)NCC2=CC=C(C=C2)CNC(=O)CCC(=O)NCC3=CC=C(C=C3)CN	Ki = 237000 nM	Non binder
T27602	Cationic trypsinogen	B6RPK2	4-Methoxybenzylamine	Investigative	75452	C8H11NO	137.18	COC1=CC=C(C=C1)CN	Ki = 1000000000 nM	Non binder
T27602	Cationic trypsinogen	B7BYL8	4-(Aminomethyl)-N-(2-phenylethyl)benzamide	Investigative	16794642	C16H18N2O	254.33	C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN	Ki = 299916251.9 nM	Non binder
T27602	Cationic trypsinogen	B7C0EO	1,4-Bis[[(S)-1-methyl-2-oxo-2-[4-(aminomethyl)benzylamino]ethyl]carbamoyloxymethyl]benzene	Investigative	44316048	C32H40N6O6	604.7	C[C@@H](C(=O)NCC1=CC=C(C=C1)CN)NC(=O)OCC2=CC=C(C=C2)COC(=O)N[C@@H](C)C(=O)NCC3=CC=C(C=C3)CN	Ki = 273000 nM	Non binder
T27602	Cationic trypsinogen	B7LYX9	3alpha-(4-Amidinobutyl)-1,2,3,3aalpha,8,8abeta-hexahydroindeno[2,1-b]pyrrole-2-one	Investigative	44290501	C16H21N3O	271.36	C1[C@H]2[C@@H]([C@H](C(=O)N2)CCCCC(=N)N)C3=CC=CC=C31	IC50 > 200000 nM	Non binder
T27602	Cationic trypsinogen	B80ZSY	Ethyl 4-(aminomethyl)benzoate	Investigative	436161	C10H13NO2	179.22	CCOC(=O)C1=CC=C(C=C1)CN	Ki = 357272838.2 nM	Non binder
T27602	Cationic trypsinogen	B8MF4U	3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcarbamoyl]-methyl}-2-phenylmethanesulfonylamino-propionamide	Investigative	44372840	C20H25N5O6S	463.5	C1=CC=C(C=C1)CS(=O)(=O)N[C@H](CO)C(=O)NCC(=O)NCC2=CC=C(C=C2)/C(=N/O)/N	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B8Q0MJ	Tert-butyl (3S)-4-[[3-(1-aminoisoquinolin-6-yl)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]-3-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-4-oxobutanoate	Investigative	9831694	C35H47N5O7S	681.8	CC1=CC(=C(C(=C1S(=O)(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)NC(CC2=CC3=C(C=C2)C(=NC=C3)N)C(=O)N4CCCCC4)C)C)OC	IC50 = 378000 nM	Non binder
T27602	Cationic trypsinogen	B9H5SI	N-(1H-Indol-5-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-2-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide	Investigative	9888145	C23H24N6O2	416.5	CC1=CN=C(C(=O)N1CC(=O)NCC2=CC3=C(C=C2)NC=C3)NCCC4=CC=CC=N4	Ki = 290000 nM	Non binder
T27602	Cationic trypsinogen	B9M6XN	{1-[1-(4-Amino-1-formyl-butylcarbamoyl)-2-methyl-propylcarbamoyl]-3-methyl-butyl}-carbamic acid benzyl ester	Investigative	14488978	C24H38N4O5	462.6	CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCN)C=O)NC(=O)OCC1=CC=CC=C1	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	B9MU1R	1beta,5beta-Bis[4-(6-aminohexylcarbamoyl)piperazinocarbonyloxy]cyclooctane	Investigative	18397360	C32H60N8O6	652.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCCCCCCN)OC(=O)N3CCN(CC3)C(=O)NCCCCCCN	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	B9UZT3	Benzoic acid, 4-(aminomethyl)-, propyl ester	Investigative	43248030	C11H15NO2	193.24	CCCOC(=O)C1=CC=C(C=C1)CN	Ki = 500034535 nM	Non binder
T27602	Cationic trypsinogen	BA52ER	4-Benzyloxybenzylamine	Investigative	4292845	C14H15NO	213.27	C1=CC=C(C=C1)COC2=CC=C(C=C2)CN	Ki = 399944749.8 nM	Non binder
T27602	Cationic trypsinogen	BA84QW	(S)-1-((R)-2-Amino-3-phenyl-propionyl)-pyrrolidine-2-carboxylic acid 2-(2-amino-ethyl)-5-chloro-benzylamide	Investigative	44344185	C23H29ClN4O2	429	C1C[C@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)N)C(=O)NCC3=C(C=CC(=C3)Cl)CCN	Ki = 252000 nM	Non binder
T27602	Cationic trypsinogen	BAH0Z8	1beta,5beta-Bis[4-[2-[1-(1-iminoethyl)-4-piperidinyl]ethylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	44315635	C38H66N10O6	759	CC(=N)N1CCC(CC1)CCNC(=O)N2CCN(CC2)C(=O)OC3CCCC(CCC3)OC(=O)N4CCN(CC4)C(=O)NCCC5CCN(CC5)C(=N)C	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BAI39G	(2S)-1-[(2R)-2-Amino-3,3-diphenylpropanoyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-ylmethyl)pyrrolidine-2-carboxamide	Investigative	10187311	C28H33N5O2	471.6	C1C[C@H](N(C1)C(=O)[C@@H](C(C2=CC=CC=C2)C3=CC=CC=C3)N)C(=O)NCC4CCC5=C(C4)C=NN5	Ki = 216600 nM	Non binder
T27602	Cationic trypsinogen	BAZ79C	Chembl432400	Investigative	73353029	C26H42N4O3S	490.7	CC[C@H](C)[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N(CCCCCCN)C2CSCCC2=O)N	Ki = 1700000 nM	Non binder
T27602	Cationic trypsinogen	BB5W3F	N-Benzyl-2-(6-methyl-2-oxo-3-phenylmethanesulfonylamino-2H-pyridin-1-yl)-acetamide	Investigative	44344067	C22H23N3O4S	425.5	CC1=CC=C(C(=O)N1CC(=O)NCC2=CC=CC=C2)NS(=O)(=O)CC3=CC=CC=C3	Ki = 466000 nM	Non binder
T27602	Cationic trypsinogen	BC0DT5	{1-[1-(5-Amino-1-formyl-pentylcarbamoyl)-2-methyl-propylcarbamoyl]-3-methyl-butyl}-carbamic acid benzyl ester	Investigative	14488970	C25H40N4O5	476.6	CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C=O)NC(=O)OCC1=CC=CC=C1	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	BC18OI	1beta,5beta-Bis[4-(4-aminobutylcarbamoyl)piperazinocarbonyloxy]cyclooctane	Investigative	18397353	C28H52N8O6	596.8	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCCCCN)OC(=O)N3CCN(CC3)C(=O)NCCCCN	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BCK84P	(4-Benzyloxy-benzyl)-pyridin-4-yl-amine	Investigative	9860803	C19H18N2O	290.4	C1=CC=C(C=C1)COC2=CC=C(C=C2)CNC3=CC=NC=C3	Ki = 233000 nM	Non binder
T27602	Cationic trypsinogen	BCZQ32	N-(2-Amino-benzyl)-2-(6-methyl-2-oxo-3-phenylmethanesulfonylamino-2H-pyridin-1-yl)-acetamide	Investigative	44344167	C22H24N4O4S	440.5	CC1=CC=C(C(=O)N1CC(=O)NCC2=CC=CC=C2N)NS(=O)(=O)CC3=CC=CC=C3	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BDH93V	Met-Phe-Leu-Glu-Ala-Ile-Pro-Lys	Investigative	44273648	C45H73N9O11S	948.2	CC[C@@H](C)[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](CCCCN)C(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](CCSC)N	Ki = 540000 nM	Non binder
T27602	Cationic trypsinogen	BE4NJ5	1beta,5beta-Bis[4-[4-(4-piperidinyl)butyryl]piperazinocarbonyloxy]cyclooctane	Investigative	44315605	C36H62N6O6	674.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)CCCC3CCNCC3)OC(=O)N4CCN(CC4)C(=O)CCCC5CCNCC5	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BE6QN7	1beta,5beta-Bis[4-(1-amidino-4-piperidinylmethylcarbamoyl)piperazinocarbonyloxy]cyclooctane	Investigative	18397380	C34H60N12O6	732.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCC3CCN(CC3)C(=N)N)OC(=O)N4CCN(CC4)C(=O)NCC5CCN(CC5)C(=N)N	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BEO67L	1beta,5beta-Bis[4-(1-amidino-4-piperidinylacetyl)piperazinocarbonyloxy]cyclooctane	Investigative	18397341	C34H58N10O6	702.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)CC3CCN(CC3)C(=N)N)OC(=O)N4CCN(CC4)C(=O)CC5CCN(CC5)C(=N)N	Ki = 445000 nM	Non binder
T27602	Cationic trypsinogen	BET0B2	N-[2-(2-Amino-ethyl)-benzyl]-2-(6-methyl-2-oxo-3-phenylmethanesulfonylamino-2H-pyridin-1-yl)-acetamide	Investigative	44344097	C24H28N4O4S	468.6	CC1=CC=C(C(=O)N1CC(=O)NCC2=CC=CC=C2CCN)NS(=O)(=O)CC3=CC=CC=C3	Ki = 437000 nM	Non binder
T27602	Cationic trypsinogen	BF6VB7	2-[6-Chloro-3-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-N-(4-methoxy-pyridin-2-ylmethyl)-acetamide	Investigative	11091843	C20H19ClF2N6O3	464.9	COC1=CC(=NC=C1)CNC(=O)CN2C(=CN=C(C2=O)NCC(C3=CC=CC=N3)(F)F)Cl	Ki = 665000 nM	Non binder
T27602	Cationic trypsinogen	BF84DB	2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl)-N-pyridin-4-ylmethyl-acetamide	Investigative	11079364	C21H23N5O2	377.4	CC1=CN=C(C(=O)N1CC(=O)NCC2=CC=NC=C2)NCCC3=CC=CC=C3	Ki = 251000 nM	Non binder
T27602	Cationic trypsinogen	BG0YE6	2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl)-N-pyridin-3-ylmethyl-acetamide	Investigative	11025238	C21H23N5O2	377.4	CC1=CN=C(C(=O)N1CC(=O)NCC2=CN=CC=C2)NCCC3=CC=CC=C3	Ki = 898000 nM	Non binder
T27602	Cationic trypsinogen	BG1L8J	1beta,5beta-Bis[4-[1-(1-iminoethyl)-4-piperidinylmethylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	44315636	C36H62N10O6	730.9	CC(=N)N1CCC(CC1)CNC(=O)N2CCN(CC2)C(=O)OC3CCCC(CCC3)OC(=O)N4CCN(CC4)C(=O)NCC5CCN(CC5)C(=N)C	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BG8HI9	Benzoic acid, 4-(aminomethyl)-, butyl ester	Investigative	43267452	C12H17NO2	207.27	CCCCOC(=O)C1=CC=C(C=C1)CN	Ki = 909913272.6 nM	Non binder
T27602	Cationic trypsinogen	BGX91W	N-[3-(1,3-Benzothiazol-2-yl)-1-(4-ethylpiperidin-1-yl)-1-oxopropan-2-yl]-3,3-dimethyl-2,4-dihydro-1H-quinoline-8-sulfonamide	Investigative	44287043	C28H36N4O3S2	540.7	CCC1CCN(CC1)C(=O)C(CC2=NC3=CC=CC=C3S2)NS(=O)(=O)C4=CC=CC5=C4NCC(C5)(C)C	Ki = 260000 nM	Non binder
T27602	Cationic trypsinogen	BH3O5E	(2S)-1-[(2R)-2-(Benzylsulfonylamino)-3-cyclohexylpropanoyl]-N-(5,6,7,8-tetrahydroquinazolin-6-ylmethyl)pyrrolidine-2-carboxamide	Investigative	44378887	C30H41N5O4S	567.7	C1CCC(CC1)C[C@H](C(=O)N2CCC[C@H]2C(=O)NCC3CCC4=NC=NC=C4C3)NS(=O)(=O)CC5=CC=CC=C5	Ki = 342000 nM	Non binder
T27602	Cationic trypsinogen	BHS3P4	2-[3-(2,2-Difluoro-2-pyridin-2-yl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-N-(3-fluoro-pyridin-2-ylmethyl)-acetamide	Investigative	11004280	C19H17F3N6O2	418.4	C1=CC=NC(=C1)C(CNC2=NC=CN(C2=O)CC(=O)NCC3=C(C=CC=N3)F)(F)F	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BI7BV8	4-Methoxy-N-methyl-N-(4-oxo-4H-benzo[d][1,3]thiazin-2-yl)-benzenesulfonamide	Investigative	15541225	C16H14N2O4S2	362.4	CN(C1=NC2=CC=CC=C2C(=O)S1)S(=O)(=O)C3=CC=C(C=C3)OC	IC50 > 200000 nM	Non binder
T27602	Cationic trypsinogen	BIG32A	2-[3-(2,2-Difluoro-2-pyridin-2-yl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-N-(4-methyl-pyridin-2-ylmethyl)-acetamide	Investigative	9954289	C21H22F2N6O2	428.4	CC1=CC(=NC=C1)CNC(=O)CN2C(=CN=C(C2=O)NCC(C3=CC=CC=N3)(F)F)C	Ki = 431000 nM	Non binder
T27602	Cationic trypsinogen	BIXQ31	3-Phenylpropyl 4-(aminomethyl)benzoate	Investigative	44365668	C17H19NO2	269.34	C1=CC=C(C=C1)CCCOC(=O)C2=CC=C(C=C2)CN	Ki = 500034535 nM	Non binder
T27602	Cationic trypsinogen	BJ7TL1	Thrombin Inhibitor 2	Investigative	9955534	C19H16ClF3N6O2	452.8	C1=CC=NC(=C1)C(CNC2=NC=C(N(C2=O)CC(=O)NCC3=C(C=CC=N3)F)Cl)(F)F	Ki = 202000 nM	Non binder
T27602	Cationic trypsinogen	BK15SU	{1-[1-(4-Amino-1-formyl-butylcarbamoyl)-2-phenyl-ethylcarbamoyl]-3-methyl-butyl}-carbamic acid benzyl ester	Investigative	14488974	C28H38N4O5	510.6	CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN)C=O)NC(=O)OCC2=CC=CC=C2	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	BKFM05	2-(6-Cyano-3-(2,2-difluoro-2-(pyridin-2-yl)ethylamino)-2-oxopyrazin-1(2H)-yl)-N-((3-fluoropyridin-2-yl)methyl)acetamide	Investigative	9824657	C20H16F3N7O2	443.4	C1=CC=NC(=C1)C(CNC2=NC=C(N(C2=O)CC(=O)NCC3=C(C=CC=N3)F)C#N)(F)F	Ki = 213000 nM	Non binder
T27602	Cationic trypsinogen	BKN5P8	2-[6-Chloro-3-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-N-(3-methoxy-pyridin-2-ylmethyl)-acetamide	Investigative	10983472	C20H19ClF2N6O3	464.9	COC1=C(N=CC=C1)CNC(=O)CN2C(=CN=C(C2=O)NCC(C3=CC=CC=N3)(F)F)Cl	Ki = 706000 nM	Non binder
T27602	Cationic trypsinogen	BL30UG	Methyl 4-(aminomethyl)benzoate	Investigative	571728	C9H11NO2	165.19	COC(=O)C1=CC=C(C=C1)CN	Ki = 434510224.2 nM	Non binder
T27602	Cationic trypsinogen	BLE9N7	(2S)-1-[(2R)-2-(Benzylsulfonylamino)-3-cyclohexylpropanoyl]-N-(2-methyl-4,5,6,7-tetrahydroindazol-5-yl)pyrrolidine-2-carboxamide	Investigative	44378759	C29H41N5O4S	555.7	CN1C=C2CC(CCC2=N1)NC(=O)[C@@H]3CCCN3C(=O)[C@@H](CC4CCCCC4)NS(=O)(=O)CC5=CC=CC=C5	Ki = 730300 nM	Non binder
T27602	Cationic trypsinogen	BLK85Y	Methyl 2-[(1R,3aS,8bS)-1-(5-amino-5-iminopentyl)-2-oxo-1,3a,4,8b-tetrahydroindeno[2,1-b]pyrrol-3-yl]acetate	Investigative	44290379	C19H25N3O3	343.4	COC(=O)CN1[C@H]2CC3=CC=CC=C3[C@@H]2[C@H](C1=O)CCCCC(=N)N	IC50 > 200000 nM	Non binder
T27602	Cationic trypsinogen	BMBF42	Methyl (2S,4S)-4-amino-2-[[(2S,4S)-4-amino-2-[3-[(1R,3R)-3-[[(2S,4S)-4-amino-2-[[(2S,4S)-4-amino-5-(1H-indol-3-yl)-3-oxo-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-5-(1H-indol-3-yl)-3-oxopentanoyl]amino]-2-oxocyclohexyl]propanoylamino]-5-(1H-indol-3-yl)-3-oxopentanoyl]amino]-5-(4-hydroxyphenyl)-3-oxopentanoate	Investigative	44404049	C68H74N12O14	1283.4	COC(=O)[C@H](C(=O)[C@H](CC1=CC=C(C=C1)O)N)NC(=O)[C@H](C(=O)[C@H](CC2=CNC3=CC=CC=C32)N)NC(=O)CC[C@H]4CCC[C@H](C4=O)NC(=O)[C@H](C(=O)[C@H](CC5=CNC6=CC=CC=C65)N)NC(=O)[C@H](C(=O)[C@H](CC7=CNC8=CC=CC=C87)N)NC(=O)OCC9=CC=CC=C9	IC50 > 400000 nM	Non binder
T27602	Cationic trypsinogen	BMG07C	4-Chlorobenzylamine	Investigative	66036	C7H8ClN	141.6	C1=CC(=CC=C1CN)Cl	Ki = 699841996 nM	Non binder
T27602	Cationic trypsinogen	BMR1Q8	Benzylamine	Investigative	7504	C7H9N	107.15	C1=CC=C(C=C1)CN	Ki = 299916251.9 nM	Non binder
T27602	Cationic trypsinogen	BN3C2F	1beta,5beta-Bis[4-[2-(1-amidino-4-piperidinyl)ethylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	18397342	C36H64N12O6	761	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCCC3CCN(CC3)C(=N)N)OC(=O)N4CCN(CC4)C(=O)NCCC5CCN(CC5)C(=N)N	Ki = 850000 nM	Non binder
T27602	Cationic trypsinogen	BN3JY6	{1-[1-(4-Amino-1-formyl-butylcarbamoyl)-3-methyl-butylcarbamoyl]-3-methyl-butyl}-carbamic acid benzyl ester	Investigative	14488972	C25H40N4O5	476.6	CC(C)C[C@@H](C(=O)N[C@@H](CCCN)C=O)NC(=O)[C@H](CC(C)C)NC(=O)OCC1=CC=CC=C1	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	BNTC04	4-Amino-1-(4-benzhydryloxy-benzyl)-pyridinium	Investigative	44292022	C25H23N2O+	367.5	C1=CC=C(C=C1)C(C2=CC=CC=C2)OC3=CC=C(C=C3)C[N+]4=CC=C(C=C4)N	Ki = 517000 nM	Non binder
T27602	Cationic trypsinogen	BOL5J8	1,4-Bis[1,3-dioxo-3-[4-(aminomethyl)benzylamino]propylaminomethyl]benzene	Investigative	44315637	C30H36N6O4	544.6	C1=CC(=CC=C1CN)CNC(=O)CC(=O)NCC2=CC=C(C=C2)CNC(=O)CC(=O)NCC3=CC=C(C=C3)CN	Ki = 317000 nM	Non binder
T27602	Cationic trypsinogen	BP04MY	{1-[1-(5-Amino-1-formyl-pentylcarbamoyl)-2-phenyl-ethylcarbamoyl]-3-methyl-butyl}-carbamic acid benzyl ester	Investigative	14488966	C29H40N4O5	524.7	CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCCN)C=O)NC(=O)OCC2=CC=CC=C2	IC50 = 400000 nM	Non binder
T27602	Cationic trypsinogen	BPH6K7	[5-[4-(6-Imidazol-1-ylhexanoyl)piperazine-1-carbonyl]oxycyclooctyl] 4-(6-imidazol-1-ylhexanoyl)piperazine-1-carboxylate	Investigative	44315604	C36H56N8O6	696.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)CCCCCN3C=CN=C3)OC(=O)N4CCN(CC4)C(=O)CCCCCN5C=CN=C5	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BPJL62	1beta,5beta-Bis[4-[4-(methylaminomethyl)benzylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	44315915	C38H56N8O6	720.9	CNCC1=CC=C(C=C1)CNC(=O)N2CCN(CC2)C(=O)OC3CCCC(CCC3)OC(=O)N4CCN(CC4)C(=O)NCC5=CC=C(C=C5)CNC	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BQD4T5	(2S)-1-[(2R)-2-(Benzylsulfonylamino)-3-cyclohexylpropanoyl]-N-(4,5,6,7-tetrahydro-2H-isoindol-5-yl)pyrrolidine-2-carboxamide	Investigative	10302418	C29H40N4O4S	540.7	C1CCC(CC1)C[C@H](C(=O)N2CCC[C@H]2C(=O)NC3CCC4=CNC=C4C3)NS(=O)(=O)CC5=CC=CC=C5	Ki = 415800 nM	Non binder
T27602	Cationic trypsinogen	BQU29F	[5-[4-[[4-(Diaminomethylideneamino)phenyl]methylcarbamoyl]piperazine-1-carbonyl]oxycyclooctyl] 4-(4-piperidin-4-ylbutanoyl)piperazine-1-carboxylate	Investigative	44315674	C36H57N9O6	711.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)N=C(N)N)OC(=O)N4CCN(CC4)C(=O)CCCC5CCNCC5	Ki = 262000 nM	Non binder
T27602	Cationic trypsinogen	BR30EZ	4-Phenyl-2-phenylcarboxamidopentanoic anhydride	Investigative	44355100	C36H36N2O5	576.7	C1=CC=C(C=C1)CCC(CC(=O)OC(=O)CC(CCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4	IC50 > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BRHB48	3-Amino-4-[6-(2-amino-4-carbamimidoylphenoxy)hexoxy]benzenecarboximidamide;hydrochloride	Investigative	52941705	C20H29ClN6O2	420.9	C1=CC(=C(C=C1C(=N)N)N)OCCCCCCOC2=C(C=C(C=C2)C(=N)N)N.Cl	Ki = 293000 nM	Non binder
T27602	Cationic trypsinogen	BS01HF	1beta,5beta-Bis[4-(5-aminopentylcarbamoyl)piperazinocarbonyloxy]cyclooctane	Investigative	18397359	C30H56N8O6	624.8	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCCCCCN)OC(=O)N3CCN(CC3)C(=O)NCCCCCN	Ki = 754000 nM	Non binder
T27602	Cationic trypsinogen	BS0XJ8	N-[1-(1-Amino-isoquinolin-6-ylmethyl)-2-oxo-2-piperidin-1-yl-ethyl]-2-(naphthalene-2-sulfonylamino)-acetamide	Investigative	44374707	C29H31N5O4S	545.7	C1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)C(=NC=C3)N)NC(=O)CNS(=O)(=O)C4=CC5=CC=CC=C5C=C4	IC50 = 255000 nM	Non binder
T27602	Cationic trypsinogen	BS1PB2	4-[[Azepane-1-carbonyl-[(4-phenylphenyl)sulfonylamino]amino]methyl]-N'-hydroxybenzenecarboximidamide	Investigative	44287039	C27H31N5O4S	521.6	C1CCCN(CC1)C(=O)N(CC2=CC=C(C=C2)/C(=N/O)/N)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4	Ki > 400000 nM	Non binder
T27602	Cationic trypsinogen	BUS19I	1beta,5beta-Bis[4-[2-(4-piperidinyl)ethylcarbamoyl]piperazinocarbonyloxy]cyclooctane	Investigative	44315913	C34H60N8O6	676.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)NCCC3CCNCC3)OC(=O)N4CCN(CC4)C(=O)NCCC5CCNCC5	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BVQZ19	2-(5-Chloro-6-hydroxy-1,3-benzothiazol-2-yl)guanidine	Investigative	70688369	C8H7ClN4OS	242.69	C1=C2C(=CC(=C1Cl)O)SC(=N2)N=C(N)N	Ki = 647000 nM	Non binder
T27602	Cationic trypsinogen	BWJ92U	1beta,5beta-Bis[4-[4-(2-aminoethyl)phenylacetyl]piperazinocarbonyloxy]cyclooctane	Investigative	18397350	C38H54N6O6	690.9	C1CC(CCCC(C1)OC(=O)N2CCN(CC2)C(=O)CC3=CC=C(C=C3)CCN)OC(=O)N4CCN(CC4)C(=O)CC5=CC=C(C=C5)CCN	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BX9H4P	2-(6-Methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl)-N-pyridin-2-ylmethyl-acetamide	Investigative	9842688	C21H23N5O2	377.4	CC1=CN=C(C(=O)N1CC(=O)NCC2=CC=CC=N2)NCCC3=CC=CC=C3	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BXD64A	2-[6-Chloro-3-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-N-(4-methyl-pyridin-2-ylmethyl)-acetamide	Investigative	11123202	C20H19ClF2N6O2	448.9	CC1=CC(=NC=C1)CNC(=O)CN2C(=CN=C(C2=O)NCC(C3=CC=CC=N3)(F)F)Cl	Ki = 429000 nM	Non binder
T27602	Cationic trypsinogen	BXV24M	4-Methylbenzylamine	Investigative	66035	C8H11N	121.18	CC1=CC=C(C=C1)CN	Ki = 666806769.2 nM	Non binder
T27602	Cationic trypsinogen	BZ5L3Q	4-Aminomethyl-benzoic acid hexyl ester	Investigative	44365722	C14H21NO2	235.32	CCCCCCOC(=O)C1=CC=C(C=C1)CN	Ki = 299916251.9 nM	Non binder
T27602	Cationic trypsinogen	BZ6LO2	N-[3-(4-Aminothieno[3,2-c]pyridin-2-yl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]naphthalene-2-sulfonamide	Investigative	44328503	C26H28N4O3S2	508.7	CC1CCN(CC1)C(=O)C(CC2=CC3=C(S2)C=CN=C3N)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4	IC50 = 205000 nM	Non binder
T27602	Cationic trypsinogen	BZ7VT2	2-[6-Methyl-2-oxo-3-(2-pyridin-2-yl-ethylamino)-2H-pyrazin-1-yl]-N-(1H-pyrrolo[3,2-b]pyridin-5-ylmethyl)-acetamide	Investigative	44379117	C22H23N7O2	417.5	CC1=CN=C(C(=O)N1CC(=O)NCC2=NC3=C(C=C2)NC=C3)NCCC4=CC=CC=N4	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	BZ90QC	4-(Aminomethyl)-N-naphthalen-1-ylbenzamide	Investigative	20115763	C18H16N2O	276.3	C1=CC=C2C(=C1)C=CC=C2NC(=O)C3=CC=C(C=C3)CN	Ki = 100000000 nM	Non binder
T27602	Cationic trypsinogen	BZH0C7	Benzyl 4-(aminomethyl)benzoate	Investigative	11356901	C15H15NO2	241.28	C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CN	Ki = 29991625.19 nM	Non binder
T27602	Cationic trypsinogen	D07SGS	N-(4-(benzyloxy)phenethyl)pyridin-4-amine	Investigative	44292136	C20H20N2O	304.4	C1=CC=C(C=C1)COC2=CC=C(C=C2)CCNC3=CC=NC=C3	Ki = 568000 nM	Non binder
T27602	Cationic trypsinogen	D08EUH	D-phenylalanyl-N-benzyl-L-prolinamide	Investigative	25113125	C21H25N3O2	351.4	C1C[C@H](N(C1)C(=O)[C@@H](CC2=CC=CC=C2)N)C(=O)NCC3=CC=CC=C3	Ki > 1000000 nM	Non binder
T27602	Cationic trypsinogen	D0S3VV	4-AMBA	Investigative	65526	C8H9NO2	151.16	C1=CC(=CC=C1CN)C(=O)O	Ki = 500034535 nM	Non binder