TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T88285	Lactoylglutathione lyase	D02HFD	Glutathione	Approved	124886	C10H17N3O6S	307.33	C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N	Ki = 1050000000000 nM	Non binder
T88285	Lactoylglutathione lyase	D03XYW	Fenoprofen	Approved	3342	C15H14O3	242.27	CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O	Ki = 383000 nM	Non binder
T88285	Lactoylglutathione lyase	D0W9WF	Ketoprofen	Approved	3825	C16H14O3	254.28	CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)O	Ki = 414000 nM	Non binder
T88285	Lactoylglutathione lyase	D0Y3DN	Flavonoid derivative 4	Patented	5280343	C15H10O7	302.23	C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	Ki = 66100000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B0K4FU	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]propan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279387	C18H22F3N3O6S	465.4	C1=CC(=CC(=C1)C(F)(F)F)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 102000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B0K5NJ	2-Azaniumyl-4-ethoxy-3-[[(2R)-2-hydroxypropanoyl]sulfanylmethyl]-4-oxobutanoate	Investigative	44308721; 44308722	C10H17NO6S	279.31	CCOC(=O)C(CSC(=O)[C@@H](C)O)C(C(=O)[O-])[NH3+]	Ki = 3160000 nM	Non binder
T88285	Lactoylglutathione lyase	B0WX6T	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279638	C18H22ClN3O7S	459.9	C1=CC(=CC=C1C(=O)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)Cl	Ki = 19500000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B0ZU7L	2-Amino-3-[[(2R)-2-hydroxypropanoyl]sulfanylmethyl]butanedioic acid	Investigative	44308724	C8H13NO6S	251.26	C[C@H](C(=O)SCC(C(C(=O)O)N)C(=O)O)O	Ki = 2230000 nM	Non binder
T88285	Lactoylglutathione lyase	B1I7CP	2-Amino-3-(methylcarbamoylsulfanylmethyl)butanedioic acid	Investigative	44308763	C7H12N2O5S	236.25	CNC(=O)SCC(C(C(=O)O)N)C(=O)O	Ki = 5670000 nM	Non binder
T88285	Lactoylglutathione lyase	B1ZK5I	Butyl 2-(2-hydroxy-2-phenyl-acetyl)sulfanylacetate	Investigative	315100	C14H18O4S	282.36	CCCCOC(=O)CSC(=O)C(C1=CC=CC=C1)O	Ki = 34700000 nM	Non binder
T88285	Lactoylglutathione lyase	B2G6ML	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-heptylsulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279440	C17H31N3O6S	405.5	CCCCCCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 95500000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B2JD5A	S-Butyl 2-hydroxy-2-phenylethanethioate	Investigative	315102	C12H16O2S	224.32	CCCCSC(=O)C(C1=CC=CC=C1)O	Ki = 29600000 nM	Non binder
T88285	Lactoylglutathione lyase	B2P0UE	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(4-methoxyphenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279232	C18H25N3O7S	427.5	COC1=CC=C(C=C1)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 20400000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B3FI8X	3-(4-Fluorophenyl)-2-propenamide	Investigative	923602	C9H8FNO	165.16	C1=CC(=CC=C1/C=C/C(=O)N)F	Ki = 1394000 nM	Non binder
T88285	Lactoylglutathione lyase	B46YFB	(2S)-2-Amino-5-[[3-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279622	C18H22BrN3O7S	504.4	C1=CC(=CC=C1C(=O)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)Br	Ki = 26900000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B49KZY	3-[(4-Methoxyphenyl)methylidene]pentane-2,4-dione	Investigative	240414	C13H14O3	218.25	CC(=O)C(=CC1=CC=C(C=C1)OC)C(=O)C	Ki = 383000 nM	Non binder
T88285	Lactoylglutathione lyase	B4FL3G	(2S)-2-Amino-5-[[3-[2-(4-aminophenyl)-2-oxoethyl]sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279660	C18H24N4O7S	440.5	C1=CC(=CC=C1C(=O)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)N	Ki = 2290000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B51BVJ	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanylpropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279388	C24H27N3O7S	501.6	C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 129000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B5HPG6	(2S)-2-Acetamido-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279748	C19H24BrN3O7S	518.4	CC(=O)N[C@@H](CCC(=O)NC(CSCC1=CC=C(C=C1)Br)C(=O)NCC(=O)O)C(=O)O	Ki = 40700000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B5O0WU	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-(2-phenylethylsulfanyl)propan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279353	C18H25N3O6S	411.5	C1=CC=C(C=C1)CCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 10000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B5ZLN7	Lapachol	Investigative	3884	C15H14O3	242.27	CC(=CCC1=C(C2=CC=CC=C2C(=O)C1=O)O)C	Ki = 26900000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B6MC7D	3-(3-Bromopropoxy)-4-chloro-7-(3-phenylureido)isocoumarin	Investigative	10433984	C19H16BrClN2O4	451.7	C1=CC=C(C=C1)NC(=O)NC2=CC3=C(C=C2)C(=C(OC3=O)OCCCBr)Cl	Ki = 63100000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B8DFH4	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-(5-phenylpentylsulfanyl)propan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279138	C21H31N3O6S	453.6	C1=CC=C(C=C1)CCCCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 132000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B8EVG6	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-pentylsulfanylpropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279267	C15H27N3O6S	377.5	CCCCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 36300000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B90WLM	2-Amino-3-(propanoylsulfanylmethyl)butanedioic acid	Investigative	44308536	C8H13NO5S	235.26	CCC(=O)SCC(C(C(=O)O)N)C(=O)O	Ki = 1980000 nM	Non binder
T88285	Lactoylglutathione lyase	B9IS5W	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(2-chlorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279597	C17H22ClN3O6S	431.9	C1=CC=C(C(=C1)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)Cl	Ki = 14800000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B9P3IQ	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(4-methylphenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279252	C18H25N3O6S	411.5	CC1=CC=C(C=C1)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 30900000000000 nM	Non binder
T88285	Lactoylglutathione lyase	B9RSV5	S-Butyl 2-hydroxypropanethioate	Investigative	303544	C7H14O2S	162.25	CCCCSC(=O)C(C)O	Ki = 12900000 nM	Non binder
T88285	Lactoylglutathione lyase	B9XRJ1	(3-Nitrobenzylidene)propanedioic acid	Investigative	4202587	C10H7NO6	237.17	C1=CC(=CC(=C1)[N+](=O)[O-])C=C(C(=O)O)C(=O)O	Ki = 426000 nM	Non binder
T88285	Lactoylglutathione lyase	B9ZH1L	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[2-(4-hydroxyphenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279640	C18H23N3O8S	441.5	C1=CC(=CC=C1C(=O)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)O	Ki = 5130000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BAQ5V1	S-Benzyl 2-hydroxypropanethioate	Investigative	303545	C10H12O2S	196.27	CC(C(=O)SCC1=CC=CC=C1)O	Ki = 5500000 nM	Non binder
T88285	Lactoylglutathione lyase	BAZ69H	S-(N-Methyl-N-hydroxycarbomyl)glutathione	Investigative	44308719; 44308720	C9H16N2O6S	280.3	CCOC(=O)C(CSC(=O)N(C)O)C(C(=O)[O-])[NH3+]	Ki = 680000 nM	Non binder
T88285	Lactoylglutathione lyase	BB40SH	S-Methylglutathione	Investigative	115260	C11H19N3O6S	321.35	CSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 240000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BBN93M	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(3-methylphenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279578	C18H25N3O6S	411.5	CC1=CC(=CC=C1)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 13500000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BBYH46	(2S)-2-Amino-5-[[3-butylsulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279136	C14H25N3O6S	363.43	CCCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 35500000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BE1O5D	(2S)-2-Amino-5-[[3-benzylsulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279301	C17H23N3O6S	397.4	C1=CC=C(C=C1)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 10700000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BF14JX	Methyl 3-(2-hydroxy-2-phenyl-acetyl)sulfanylpropanoate	Investigative	315101	C12H14O4S	254.3	COC(=O)CCSC(=O)C(C1=CC=CC=C1)O	Ki = 38600000 nM	Non binder
T88285	Lactoylglutathione lyase	BG2L0Q	Methyl 2-(2-hydroxy-2-phenylacetyl)sulfanylacetate	Investigative	312236	C11H12O4S	240.28	COC(=O)CSC(=O)C(C1=CC=CC=C1)O	Ki = 8200000 nM	Non binder
T88285	Lactoylglutathione lyase	BH6E3Z	S-Benzyl 2-hydroxy-2-phenylethanethioate	Investigative	312235	C15H14O2S	258.3	C1=CC=C(C=C1)CSC(=O)C(C2=CC=CC=C2)O	Ki = 6300000 nM	Non binder
T88285	Lactoylglutathione lyase	BJMV08	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(3-chlorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279598	C17H22ClN3O6S	431.9	C1=CC(=CC(=C1)Cl)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 47900000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BK4IL7	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-(3-phenylpropylsulfanyl)propan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279305	C19H27N3O6S	425.5	C1=CC=C(C=C1)CCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 112000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BMT57Z	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-(4-phenylbutylsulfanyl)propan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279304	C20H29N3O6S	439.5	C1=CC=C(C=C1)CCCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 25100000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BNK26E	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(4-fluorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279365	C17H22FN3O6S	415.4	C1=CC(=CC=C1CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)F	Ki = 33100000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BORL86	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-phenacylsulfanylpropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279161	C18H23N3O7S	425.5	C1=CC=C(C=C1)C(=O)CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 5130000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BPL0C6	2-Amino-5-[[1-[(2-ethoxy-2-oxoethyl)amino]-5-(hydroxyamino)-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid	Investigative	390761; 44375033	C14H24N4O8	376.36	CCOC(=O)CNC(=O)C(CCC(=O)NO)NC(=O)CCC(C(=O)O)N	IC50 = 1624600 nM	Non binder
T88285	Lactoylglutathione lyase	BR3W9U	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-(3-oxo-3-phenylpropyl)sulfanylpropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279352	C19H25N3O7S	439.5	C1=CC=C(C=C1)C(=O)CCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 25700000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BRCP42	(2S)-2-Amino-5-[[(2S)-1-(carboxymethylamino)-3-ethylsulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	14368897	C12H21N3O6S	335.38	CCSC[C@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 2090000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BSIF15	5-[[3-[(4-Bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279747	C17H21BrN2O6S	461.3	C1=CC(=CC=C1CSCC(C(=O)NCC(=O)O)NC(=O)CCCC(=O)O)Br	Ki = 3720000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BSJ68E	Naringenin	Investigative	439246	C15H12O5	272.25	C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O	Ki = 57500000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BUB0W7	Ethyl ferulate	Investigative	736681	C12H14O4	222.24	CCOC(=O)/C=C/C1=CC(=C(C=C1)O)OC	Ki = 385000 nM	Non binder
T88285	Lactoylglutathione lyase	BUH25T	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(4-chlorophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279347	C17H22ClN3O6S	431.9	C1=CC(=CC=C1CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)Cl	Ki = 126000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BV24QG	2-Carbethoxy-5,7-dihydroxy-4'-methoxyisoflavone	Investigative	5380187	C19H16O7	356.3	CCOC(=O)C1=C(C(=O)C2=C(C=C(C=C2O1)O)O)C3=CC=C(C=C3)OC	Ki = 89100000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BV2W7U	Maltol	Investigative	8369	C6H6O3	126.11	CC1=C(C(=O)C=CO1)O	Ki = 4470000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BV40QR	(2S)-2-Amino-5-[[1-(carboxymethylamino)-1-oxo-3-propylsulfanylpropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279707	C13H23N3O6S	349.41	CCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 10700000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BW20ON	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-octylsulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279427	C18H33N3O6S	419.5	CCCCCCCCSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N	Ki = 100000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BYFK19	(2S)-2-Amino-5-[[1-(carboxymethylamino)-3-[(4-cyanophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid	Investigative	44279579	C18H22N4O6S	422.5	C1=CC(=CC=C1CSCC(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)C#N	Ki = 87100000000000 nM	Non binder
T88285	Lactoylglutathione lyase	BYV63U	Methyl 4-fluorocinnamate	Investigative	958751	C10H9FO2	180.17	COC(=O)/C=C/C1=CC=C(C=C1)F	Ki = 1907000 nM	Non binder
T88285	Lactoylglutathione lyase	D01UYI	CHRYSIN	Investigative	5281607	C15H10O4	254.24	C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O	Ki = 12000000000000 nM	Non binder
T88285	Lactoylglutathione lyase	D0MF5Y	3,7,3',4'-TETRAHYDROXYFLAVONE	Investigative	5281614	C15H10O6	286.24	C1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)O	Ki = 75900000000000 nM	Non binder
T88285	Lactoylglutathione lyase	D0NJ4H	MORIN	Investigative	5281670	C15H10O7	302.23	C1=CC(=C(C=C1O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O	Ki = 33100000000000 nM	Non binder