TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T82577	Angiotensin-converting enzyme	D0DZ3X	L-Proline	Approved	145742	C5H9NO2	115.13	C1C[C@H](NC1)C(=O)O	Ki = 86000 nM	Poor binder
T82577	Angiotensin-converting enzyme	D0Q0PR	Novobiocin	Approved	54675769	C31H36N2O11	612.6	.	Ki = 167000 nM	Poor binder
T82577	Angiotensin-converting enzyme	D0T2IQ	Actinonin	Terminated	443600	C19H35N3O5	385.5	CCCCC[C@H](CC(=O)NO)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1CO	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B23HUD	3,4,5,6-Tetrahydroxyxanthone	Investigative	10015450	C13H8O6	260.2	C1=CC(=C(C2=C1C(=O)C3=C(O2)C(=C(C=C3)O)O)O)O	Ki = 126000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B29LPH	2-(2,3,4,5,6-Pentafluorophenyl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide	Investigative	44561932	C13H8F5NO3S	353.27	C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=C(C(=C(C(=C3F)F)F)F)F	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B2IC5Y	2-(2-Methyl-3-sulfanylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid	Investigative	44301492	C14H17NO3S	279.36	CC(CS)C(=O)N1CCC2=CC=CC=C2C1C(=O)O	IC50 = 58000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B36ZIR	2-(6-Bromopyridin-2-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide	Investigative	44561892	C12H11BrN2O3S	343.2	C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=NC(=CC=C3)Br	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B39MWU	Alanylphenylalanine	Investigative	96814	C12H16N2O3	236.27	C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)N	IC50 = 190546.07 nM	Poor binder
T82577	Angiotensin-converting enzyme	B3B1AO	(2S)-2-[(2-Sulfanylacetyl)amino]butanedioic acid	Investigative	44316833	C6H9NO5S	207.21	C([C@@H](C(=O)O)NC(=O)CS)C(=O)O	IC50 = 77624.71 nM	Poor binder
T82577	Angiotensin-converting enzyme	B3KYM0	4,5-Dimethyl-2-(2,3,5,6-tetrafluoropyridin-4-yl)-isothiazol-3(2H)-one 1,1-dioxide	Investigative	44561930	C10H6F4N2O3S	310.23	CC1=C(S(=O)(=O)N(C1=O)C2=C(C(=NC(=C2F)F)F)F)C	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B3S2KC	Ala-Tyr	Investigative	92946	C12H16N2O4	252.27	C[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)N	IC50 = 87096.36 nM	Poor binder
T82577	Angiotensin-converting enzyme	B3VCP2	5-Chloro-2-oxo-1,2,3,4-tetrahydroquinazoline-3-acetohydroxamic acid	Investigative	10467565	C10H10ClN3O3	255.66	C1C2=C(C=CC=C2Cl)NC(=O)N1CC(=O)NO	IC50 = 90000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B4ADZ2	2-(2,3,5,6-Tetrafluoropyridin-4-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide	Investigative	25141405	C12H8F4N2O3S	336.26	C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=C(C(=NC(=C3F)F)F)F	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B7PMG1	2-(6-Chloropyridin-2-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide	Investigative	44561891	C12H11ClN2O3S	298.75	C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=NC(=CC=C3)Cl	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B82EAW	Asparaptine	Investigative	122179189	C10H18N4O3S2	306.4	C1C(CSS1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O	IC50 = 113000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B82SQM	(2R)-1-[(2S,3S)-2-Amino-3-methylpentanoyl]pyrrolidine-2-carboxylic acid	Investigative	6992873	C11H20N2O3	228.29	CC[C@H](C)[C@@H](C(=O)N1CCC[C@@H]1C(=O)O)N	IC50 = 128824.96 nM	Poor binder
T82577	Angiotensin-converting enzyme	B8RS5T	1,1-Dioxo-2-pyridin-4-yl-4,5,6,7-tetrahydro-1,2-benzothiazol-3-one;perchloric acid	Investigative	49797481	C12H13ClN2O7S	364.76	C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=CC=NC=C3.OCl(=O)(=O)=O	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	B8ZI6F	(2R)-1-[(2S)-2-Amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carboxylic acid	Investigative	44324624	C11H21N5O3	271.32	C1C[C@@H](N(C1)C(=O)[C@H](CCCN=C(N)N)N)C(=O)O	IC50 = 181970.09 nM	Poor binder
T82577	Angiotensin-converting enzyme	BA84UV	(3R)-2-[(2S)-2-[[(2S)-1-Ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid	Investigative	71750764	C27H34N2O7	498.6	CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=CC(=C(C=C3C[C@@H]2C(=O)O)OC)OC	IC50 = 90000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BCPH38	(R)-2-[(6S,7S)-6-((R)-2-Mercapto-3-phenyl-propionylamino)-5-oxo-7-phenyl-[1,4]oxazepan-4-yl]-4-methyl-pentanoic acid	Investigative	44314997	C26H32N2O5S	484.6	CC(C)C[C@H](C(=O)O)N1CCO[C@H]([C@@H](C1=O)NC(=O)[C@@H](CC2=CC=CC=C2)S)C3=CC=CC=C3	Ki = 50000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BCT84S	1,3,5,6-Tetrahydroxyxanthone	Investigative	5479774	C13H8O6	260.2	C1=CC(=C(C2=C1C(=O)C3=C(C=C(C=C3O2)O)O)O)O	IC50 = 69200 nM	Poor binder
T82577	Angiotensin-converting enzyme	BD2V9Y	N-(Carboxymethyl)-N-(3-Phenylpropyl)glycyl-N-Methyl-L-Histidinamide	Investigative	54589400	C20H27N5O4	401.5	CNC(=O)[C@H](CC1=CN=CN1)NC(=O)CN(CCCC2=CC=CC=C2)CC(=O)O	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BEB9O5	5-Methyl-4-phenyl-2-(2,3,5,6-tetrafluoropyridin-4-yl)-isothiazol-3(2H)-one 1,1-dioxide	Investigative	44561931	C15H8F4N2O3S	372.3	CC1=C(C(=O)N(S1(=O)=O)C2=C(C(=NC(=C2F)F)F)F)C3=CC=CC=C3	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BF5JM8	(S)-2-((S)-5-Benzamido-4-oxo-6-phenylhexanamido)-3-(1H-indol-3-yl)propanoic acid	Investigative	11992410	C30H29N3O5	511.6	C1=CC=C(C=C1)C[C@@H](C(=O)CCC(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O)NC(=O)C4=CC=CC=C4	Ki = 195700 nM	Poor binder
T82577	Angiotensin-converting enzyme	BF8G5M	N-[(2S)-1-[[(2S,3S,5S)-1-Cyclohexyl-3,5-dihydroxy-6-methylheptan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-1H-indole-2-carboxamide	Investigative	10436816	C29H41N5O4	523.7	CC(C)[C@H](C[C@@H]([C@H](CC1CCCCC1)NC(=O)[C@H](CC2=CN=CN2)NC(=O)C3=CC4=CC=CC=C4N3)O)O	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BFNX31	(S)-2-((S)-5-Benzamido-4-oxo-6-phenylhexanamido)-3-phenylpropanoic acid	Investigative	11992491	C28H28N2O5	472.5	C1=CC=C(C=C1)C[C@@H](C(=O)CCC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)NC(=O)C3=CC=CC=C3	Ki = 84300 nM	Poor binder
T82577	Angiotensin-converting enzyme	BH3N7R	(R)-1-[(S)-1-((S)-2-Amino-3-phenyl-propionyl)-pyrrolidine-2-carbonyl]-pyrrolidine-2-carboxylic acid	Investigative	44352420	C19H25N3O4	359.4	C1C[C@@H](N(C1)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC3=CC=CC=C3)N)C(=O)O	IC50 = 78000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BHD70P	N-(3-Mercaptopropanoyl)-L-cysteine	Investigative	12785186	C6H11NO3S2	209.3	C(CS)C(=O)N[C@@H](CS)C(=O)O	IC50 = 67608.3 nM	Poor binder
T82577	Angiotensin-converting enzyme	BHU24K	2,3-Dihydro-1,4-benzodioxin-5-yl (2S,4R)-4-benzoylsulfanyl-2-[(2,4,5-trifluorophenyl)methoxymethyl]pyrrolidine-1-carboxylate	Investigative	11192220	C28H24F3NO6S	559.6	C1COC2=C(O1)C=CC=C2OC(=O)N3C[C@@H](C[C@H]3COCC4=CC(=C(C=C4F)F)F)SC(=O)C5=CC=CC=C5	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BJ6Z4C	1-(3-Hydroxycarbamoyl-propionyl)-pyrrolidine-2-carboxylic acid	Investigative	44305071	C9H14N2O5	230.22	C1CC(N(C1)C(=O)CCC(=O)NO)C(=O)O	IC50 = 50000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BJSA39	1-(4-Carboxy-butyryl)-pyrrolidine-2-carboxylic acid	Investigative	44459080	C10H15NO5	229.23	C1C[C@H](N(C1)C(=O)CCCC(=O)O)C(=O)O	IC50 = 70000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BK2X0P	(3S)-3-(Benzenesulfonyl)-N-hydroxyheptanamide	Investigative	10613145	C13H19NO4S	285.36	CCCC[C@@H](CC(=O)NO)S(=O)(=O)C1=CC=CC=C1	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BK7FI0	L-Alanyl-L-proline	Investigative	83525	C8H14N2O3	186.21	C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N	Ki = 50000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BL15OI	beta-(Acetylthio)isobutyric acid benzylamide	Investigative	2828749	C13H17NO2S	251.35	CC(CSC(=O)C)C(=O)NCC1=CC=CC=C1	IC50 = 200000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BMRD86	[1-(5-Benzamido-4-oxo-6-phenylhexanoyl)pyrrolidin-2-yl]phosphonic acid	Investigative	44266804	C23H27N2O6P	458.4	C1CC(N(C1)C(=O)CCC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)P(=O)(O)O	IC50 = 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BORB10	Isopropyl (2S,4R)-2-{[(2,5-difluorobenzyl)amino]methyl}-4-mercaptopyrrolidine-1-carboxylate	Investigative	44400838	C16H22F2N2O2S	344.4	CC(C)OC(=O)N1C[C@@H](CC1CNCC2=C(C=CC(=C2)F)F)S	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BP73OX	1,1-Dioxo-2-(2,3,5,6-tetrafluoropyridin-4-yl)-1,2-benzothiazol-3-one	Investigative	555078	C12H4F4N2O3S	332.23	C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)C3=C(C(=NC(=C3F)F)F)F	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BS31QE	2-(1-Formyl-2-phenyl-ethylamino)-4-phenyl-butyric acid	Investigative	44368530	C19H21NO3	311.4	C1=CC=C(C=C1)CCC(C(=O)O)NC(CC2=CC=CC=C2)C=O	Ki = 50000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BT1Q5P	(5-Chloro-3,4-dihydro-1H-2,1,3-benzothiadiazine-3-acetohydroxamic acid)2,2-dioxide	Investigative	10732349	C9H10ClN3O4S	291.71	C1C2=C(C=CC=C2Cl)NS(=O)(=O)N1CC(=O)NO	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BTY50N	(2S)-1-[2-[[(2S)-2-[(4-Methylphenyl)sulfonylamino]-3-phenylpropanoyl]amino]acetyl]pyrrolidine-2-carboxylic acid	Investigative	44278891	C23H27N3O6S	473.5	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCC(=O)N3CCC[C@H]3C(=O)O	IC50 = 67000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BTZ94Y	2-(3-Mercapto-propionyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid	Investigative	44301557	C12H13NO3S	251.3	C1C2=CC=CC=C2C(N1C(=O)CCS)C(=O)O	IC50 = 58000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BUQ0O7	H-D-Ala-phe-OH	Investigative	6992396	C12H16N2O3	236.27	C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)N	IC50 = 52480.75 nM	Poor binder
T82577	Angiotensin-converting enzyme	BX0G5F	2-(3,5-Difluoropyridin-2-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide	Investigative	44561893	C12H10F2N2O3S	300.28	C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=C(C=C(C=N3)F)F	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BYJ6C7	Isoleucyl-Proline	Investigative	444876	C11H20N2O3	228.29	CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N	IC50 = 128824.96 nM	Poor binder
T82577	Angiotensin-converting enzyme	BYNO03	2-(3-Acetylsulfanyl-2-methylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid	Investigative	44301409	C16H19NO4S	321.4	CC(CSC(=O)C)C(=O)N1CCC2=CC=CC=C2C1C(=O)O	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BYS39G	US9212206, III	Investigative	102514730	C21H32FN3O5S	457.6	CC(C)C[C@@H](C(=O)N1C[C@H](C[C@H]1C(=O)N2CCC[C@H]2C(=O)N3CC[C@H](C3)C(=O)O)F)S	IC50 = 68000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BZU41M	(2S,4R)-4-Acetylsulfanyl-2-(2,4,5-trifluoro-benzyloxymethyl)-pyrrolidine-1-carboxylic acid 2,3-dihydro-benzo[1,4]dioxin-5-yl ester	Investigative	10141595	C23H22F3NO6S	497.5	CC(=O)S[C@@H]1C[C@H](N(C1)C(=O)OC2=CC=CC3=C2OCCO3)COCC4=CC(=C(C=C4F)F)F	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	BZY13G	Val-phe	Investigative	6993120	C14H20N2O3	264.32	CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)N	IC50 = 52480.75 nM	Poor binder
T82577	Angiotensin-converting enzyme	D02BTV	3-Benzenesulfinyl-heptanoic acid hydroxyamide	Investigative	9816867	C13H19NO3S	269.36	CCCCC(CC(=O)NO)S(=O)C1=CC=CC=C1	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	D08ELY	3-Benzenesulfonyl-heptanoic acid hydroxyamide	Investigative	9838786	C13H19NO4S	285.36	CCCCC(CC(=O)NO)S(=O)(=O)C1=CC=CC=C1	IC50 = 81000 nM	Poor binder
T82577	Angiotensin-converting enzyme	D0B3UN	RXP470.1	Investigative	44580458	C35H35BrClN4O10P	818	C1=CC(=CC(=C1)Cl)C2=CC=C(C=C2)C3=NOC(=C3)C[C@H](CP(=O)(C4=CC=C(C=C4)Br)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N	Ki ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	D0N6CD	3-Cyclohexanesulfonyl-heptanoic acid hydroxyamide	Investigative	10565532	C13H25NO4S	291.41	CCCCC(CC(=O)NO)S(=O)(=O)C1CCCCC1	IC50 ~ 100000 nM	Poor binder
T82577	Angiotensin-converting enzyme	D0N8YA	Bb-3497	Investigative	159596	C16H31N3O4	329.43	CCCC[C@H](CN(C=O)O)C(=O)N[C@H](C(=O)N(C)C)C(C)(C)C	IC50 ~ 100000 nM	Poor binder