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Japanese TGx project: TG-GATEs (Genomics-Assisted Toxicity Evaluation System developed by the Toxicogenomics Project in Japan) The Toxicogenomics Project (TGP) has established a large-scale toxicogenomics database known as TG-GATEs The primary goal of the TGP was to create a gene expression database by using the Affymetrix GeneChips of 150 chemicals, mainly medical drugs and the main target organ was the liver. The TGP was completed in 2007. The entire system consists of a database, an analysis system, and a prediction system and is named as TG-Genomics-Assisted Toxicity Evaluation System. 1 2 3 (132 chemicals) download Japanese TGx project excel file 
CASEINECSJRC CODEChemical NameSMILES
113-52-0204-030-7-Imipramine HydrochlorideCN(C)CCCN1c2ccccc2CCc3ccccc13
4360-12-7224-439-4-AjmalineCC[C@H]1[C@@H]2C[C@H]3[C@@H]4N(C)c5ccccc5[C@]46C[C@@H](C2[C@H]6O)N3[C@@H]1O
51803-78-2257-431-4-NimesulideCS(=O)(=O)Nc1ccc(cc1Oc2ccccc2)[N+](=O)[O-]
53-96-3200-188-6JRC-000308Acetamide, N-9h-Fluoren-2-Yl-CC(=O)Nc1ccc2c(Cc3ccccc23)c1
54-85-3200-214-6JRC-000025IsoniazidNNC(=O)c1ccncc1
59-66-5200-440-5-AcetazolamideCC(=O)Nc1nnc(s1)S(=O)(=O)N
599-79-1209-974-3-SalazosulfapyridineOC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3
107-18-6203-470-7JRC-000540Allyl AlcoholOCC=C
17321-77-6241-344-3-Clomipramine HydrochlorideCN(C)CCCN1c2ccccc2CCc3ccc(Cl)cc13
21829-25-4244-598-3-NifedipineCOC(=O)C1=C(C)NC(=C(C1c2ccccc2[N+](=O)[O-])C(=O)OC)C
32780-64-6251-211-1-5-[1-Hydroxy-2-[(1-Methyl-3-Phenylpropyl)Amino]Ethyl]Salicylamide MonohydrochlorideCC(CCc1ccccc1)NCC(O)c2ccc(O)c(c2)C(=O)N
49562-28-9256-376-3-FenofibrateCC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2
551-06-4208-990-8-1-Naphthyl Isothiocyanatec1ccc2c(c1)cccc2N=C=S
13311-84-7236-341-9JRC-000199FlutamideCC(C)C(=O)NC1=CC(=C(C=C1)[N](=O)=O)C(F)(F)F
2152-34-3218-438-8-PemolineNC1=NC(=O)C(O1)c2ccccc2
298-46-4206-062-7JRC-000006CarbazepineNC(=O)N1c2ccccc2C=Cc2ccccc12 |c:11|
33286-22-5251-443-3-(2s-Cis)-3-Acetoxy-5-[2-(Dimethylamino)Ethyl]-2,3-Dihydro-2-(4-Methoxyphenyl)-1,5-Benzothiazepin-4(5h)-One MonohydrochlorideCOc1ccc(cc1)[C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(=O)C
439-14-5207-122-5JRC-000009DiazepamC=1(c2c(N(C)C(CN1)=O)ccc(c2)Cl)c1ccccc1
50892-23-4-JRC-000549Pirinixic AcidCc1cccc(Nc2cc(Cl)nc(SCC(O)=O)n2)c1C
53-86-1200-186-5JRC-000997IndometacinCOc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
5370-01-4226-362-1-Mexiletine HydrochlorideCl.c1c(C)c(OC[C@@H](C)N)c(C)cc1
555-30-6209-089-2-MethyldopaC(O)(=O)[C@@](Cc1cc(c(O)cc1)O)(C)N
57-30-7200-322-3JRC-000405Phenobarbital Sodiumc1([C@@]2(C(NC([O-])=NC2=O)=O)CC)ccccc1.[Na+]
58-18-4200-366-3JRC-000209Methyltestosterone[H][C@@]12CC[C@](C)(O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C
59-67-6200-441-0JRC-000460Nicotinic Acidc1(cccnc1)C(O)=O
10238-21-8233-570-6-GlibenclamideCOc1ccc(Cl)cc1C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3
1069-66-5213-961-8JRC-000017Pentanoic Acid, 2-Propyl-, Sodium Salt (1:1)C(CCC)(CCC)C(=O)[O-].[Na+]
11103-57-4234-328-2-Vitamin AC\C(=C/CO)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C
1401-55-4215-753-2-Tannic Acidc1c(cc(c(c1O)O)O)C(=O)Oc1cc(cc(c1O)O)C(=O)OC[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)OC(=O)c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O)OC(=O)c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O)OC(=O)c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O)OC(=O)c1cc(c(c(c1)OC(=O)c1cc(c(c(c1)O)O)O)O)O
1404-93-9604-193-8-Vancomycin, HydrochlorideCl.[H][C@@]1(C[C@](C)(N)[C@H](O)[C@H](C)O1)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OC1=C2OC3=CC=C(C=C3Cl)[C@@H](O)[C@@H](NC(=O)[C@@H](CC(C)C)NC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@]3([H])C(C=C1OC1=CC=C(C=C1Cl)[C@@H](O)[C@]1([H])NC(=O)[C@]([H])(NC3=O)C3=CC(=C(O)C=C3)C3=C(C=C(O)C=C3O)[C@]([H])(NC1=O)C(O)=O)=C2
15663-27-1239-733-8JRC-000056Platinum, Diamminedichloro-, (Sp-4-2)-[Pt+2]([NH3])([Cl-])([Cl-])[NH3]
25316-40-9246-818-3JRC-000457(8s-Cis)-10-[(3-Amino-2,3,6-Trideoxy-Alpha-L-Lyxo-Hexopyranosyl)Oxy]-7,8,9,10-Tetrahydro-6,8,11-Trihydroxy-8-(Hydroxyacetyl)-1-Methoxynaphthacene-5,12-Dione HydrochlorideC[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)CO)O)N)O.Cl
28911-01-5249-307-3-TriazolamCc1nnc2CN=C(c3ccccc3Cl)c4cc(Cl)ccc4n12
33419-42-0251-509-1JRC-000818EtoposideCOc1cc(cc(OC)c1O)[C@H]2[C@@H]3C(COC3=O)C(O[C@@H]4O[C@@H]5CO[C@@H](C)O[C@H]5[C@H](O)[C@H]4O)c6cc7OCOc7cc26
51481-61-9257-232-2-CimetidineCN\C(=N\C#N)\NCCSCc1nc[nH]c1C
53885-35-1258-837-4-5-(O-Chlorobenzyl)-4,5,6,7-Tetrahydrothieno[3,2-C]Pyridinium ChlorideClc1ccccc1CN2CCc3sccc3C2
58-33-3200-375-2-Promethazine HydrochlorideN1(c2c(Sc3c1cccc3)cccc2)CC(N(C)C)C.Cl
58-60-6200-388-3-3'-Amino-3'-Deoxy-N,N-DimethyladenosineCN(C)c1ncnc2c1ncn2[C@@H]3O[C@H](CO)C(N)[C@H]3O
1070-11-7213-970-7-[S-(R*,R*)]-2,2'-(Ethylenediimino)Dibutan-1-Ol DihydrochlorideCCC(CO)NCCNC(CC)CO
1229-29-4214-966-8-Doxepin HydrochlorideCN(C)CC\C=C\1/c2ccccc2COc3ccccc13
126-07-8204-767-4-GriseofulvinCOC1=CC(=O)C[C@@H](C)[C@]12Oc3c(Cl)c(OC)cc(OC)c3C2=O
146-56-5205-674-1-Fluphenazine DihydrochlorideOCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1
15676-16-1239-753-7-(±)-SulpirideCCN1CCCC1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N
20187-55-7243-569-2-BendazacOC(=O)COc1nn(Cc2ccccc2)c3ccccc13
315-22-0--MonocrotalineC=12[C@@H]3[C@@H](CC[N@@]3CC1)OC([C@@H]([C@@](C)(O)[C@@](C(OC2)=O)(C)O)C)=O
315-30-0206-250-9-AllopurinolOc1ncnc2[nH]ncc12
41575-94-4255-446-0-Diammine[Cyclobutane-1,1-Dicarboxylato(2-)-O,O']PlatinumC12(C(O[Pt](OC1=O)([NH3])[NH3])=O)CCC2
50-78-2200-064-1JRC-000003Acetylsalicylic AcidO=C(Oc(c(ccc1)C(=O)O)c1)C
536-33-4208-628-9-EthionamideCCc1cc(ccn1)C(=S)N
549-18-8208-964-6JRC-000078Amitriptyline HydrochlorideCl.CN(C)CC\C=C1/c2ccccc2CCc3ccccc13
54965-24-1259-415-2-(Z)-[2-[4-(1,2-Diphenylbut-1-Enyl)Phenoxy]Ethyl]Dimethylammonium Dihydrogen 2-Hydroxypropane-1,2,3-TricarboxylateCC/C(=C(c1ccccc1)/c2ccc(cc2)OCCN(C)C)/c3ccccc3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
55-18-5200-226-1JRC-000835DiethylnitrosoamineCCN(CC)N=O
56-23-5200-262-8JRC-000257Carbon TetrachlorideClC(Cl)(Cl)Cl
58-55-9200-385-7JRC-000021TheophyllineO=C2C=1/N=C\NC=1N(C)C(=O)N2C
59-05-2200-413-8-MethotrexateCN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N[C@H](CCC(O)=O)C(O)=O
108-86-1203-623-8-BromobenzeneBrc1ccccc1
1115-70-4214-230-6-Metformin HydrochlorideCN(C)C(=N)NC(=N)N
135-23-9205-184-8JRC-000734Methapyrilene HydrochlorideCN(C)CCN(Cc1cccs1)c2ccccn2
15687-27-1239-784-6JRC-000269Benzeneacetic Acid, α-Methyl-4-(2-Methylpropyl)-CC(C)Cc1ccc(cc1)C(C)C(=O)O
17230-88-5241-270-1-DanazolC[C@]12Cc3cnoc3C=C1CC[C@@H]4[C@@H]2CC[C@@]5(C)[C@H]4CC[C@@]5(O)C#C
1953-02-2217-778-4-TioproninC[C@@H](C(NCC(O)=O)=O)S
22204-53-1244-838-7JRC-000338NaproxenCOc1ccc2cc(ccc2c1)[C@H](C)C(=O)O
24868-20-0--Dantrolene Sodium Hemiheptahydratec1(c2ccc([N+](=O)[O-])cc2)oc(\C=N\N2CC(=O)[NH-]C2=O)cc1.[Na+]
2576-47-8219-924-2-2-Bromoethylamine HydrobromideC(C[NH3+])Br.[BrH-]
38194-50-2253-819-2-SulindacCC1=C(CC(=O)O)c2cc(F)ccc2/C/1=C\c3ccc(cc3)S(=O)C
446-86-6207-175-4JRC-000503AzathioprineCn1cnc(c1Sc2ncnc3nc[nH]c23)[N+](=O)[O-]
51-52-5200-103-2JRC-000168PropylthiouracilCCCc1cc(=O)[nH]c(=S)[nH]1
56-75-7200-287-4JRC-000089ChloramphenicolOC[C@@H](NC(=O)C(Cl)Cl)[C@H](O)C1=CC=C(C=C1)[N](=O)=O
103-90-2203-157-5JRC-0000024-Acetamidophenolc1(ccc(cc1)O)NC(=O)C
118-74-1204-273-9JRC-000062HexachlorobenzeneClc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
1264-62-6215-033-8-Erythromycin Ethyl SuccinateCCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C
130-61-0204-992-8JRC-000022Thioridazine Hydrochloridec1cc2N(CC[C@@H]3[N@@](C)CCCC3)c3c(Sc2cc1)ccc(c3)SC.Cl
13010-47-4235-859-2-LomustineClCCN(N=O)C(=O)NC1CCCCC1
13292-46-1236-312-0JRC-000054Rifampicin[H][C@]1(OC(C)=O)[C@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)\C=C\C=C(C)C(=O)NC2=C(\C=N\N3CCN(C)CC3)C(O)=C3C4=C(O[C@](C)(O\C=C\[C@H](OC)[C@H]1C)C4=O)C(C)=C(O)C3=C2O
1405-41-0215-778-9JRC-000423Gentamicin, Sulfate (Salt)CN[C@@H]1[C@@H](O)[C@@H](O[C@H]2[C@H](N)C[C@H](N)[C@@H](O[C@H]3O[C@H](CN)CC[C@H]3N)[C@@H]2O)OC[C@]1(C)O
25812-30-0247-280-2JRC-000334GemfibrozilCc1ccc(C)c(OCCCC(C)(C)C(=O)O)c1
305-33-9206-164-1-Iproniazid PhosphateCC(C)NNC(=O)c1ccncc1
3737-09-5223-110-2JRC-000032Disopyramiden1ccccc1C(c2ccccc2)(C(=O)N)CCN(C(C)C)C(C)C
396-01-0206-904-3-TriamtereneNc1nc(N)c2nc(c(N)nc2n1)c3ccccc3
50-54-4200-046-3-Quinidine SulphateS(=O)(O)(O)=O.c12c([C@@H]([C@@H]3[N@@]4C[C@H](C=C)[C@@H](C3)CC4)O)ccnc1ccc(OC)c2.c12c([C@@H]([C@@H]3[N@@]4C[C@H](C=C)[C@@H](C3)CC4)O)ccnc1ccc(c2)OC
52-86-8200-155-6JRC-000084HaloperidolOC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
57-41-0200-328-6JRC-000028PhenytoinO=C1NC(=O)C(N1)(c2ccccc2)c3ccccc3
57-63-6200-342-2JRC-000049Ethinylestradiol[H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3
58-08-2200-362-1JRC-000005CaffeineO=C1C2=C(N=CN2C)N(C(=O)N1C)C
59865-13-3611-907-1JRC-000048Cyclosporine[H][C@]1(NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H](CC)NC(=O)[C@]([H])([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@]([H])(C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C1=O)C(C)C
60-56-0200-482-4JRC-000502Thiamazole[H][C@]12C[C@]([H])([C@@H]3O[C@H]13)[C@]1([H])[C@@]2([H])[C@]2(Cl)C(Cl)=C(Cl)[C@@]1(Cl)C2(Cl)Cl
1083-57-4214-109-8-BucetinCCOc1ccc(NC(=O)CC(C)O)cc1
127-48-0204-845-8-TrimethadioneCN1C(=O)OC(C)(C)C1=O
15307-79-6239-346-4JRC-000367Diclofenac Sodium[Na].OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl
1684-40-8216-867-5-1,2,3,4-Tetrahydroacridin-9-Amine MonohydrochlorideNc1c2CCCCc2nc3ccccc13
19774-82-4243-293-2JRC-000044Amiodarone Hydrochloridec1(c2c(cccc2)oc1CCCC)C(c1cc(c(OCC[NH+](CC)CC)c(c1)I)I)=O.[ClH-]
2192-20-3218-586-3-Hydroxyzine HydrochlorideO(CCN1CCN(CC1)[C@@H](c1ccccc1)c1ccc(cc1)Cl)CCO.Cl.Cl
2438-32-6219-450-6-(±)-Chlorpheniramine Maleatec1cc([C@H](CCN(C)C)c2ccccn2)ccc1Cl.OC(\C=C/C(O)=O)=O
302-22-7206-118-0-Chlormadinone AcetateCC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)C
3562-84-3222-630-7-BenzbromaroneCCc1oc2ccccc2c1C(=O)c3cc(Br)c(O)c(Br)c3
50-33-9200-029-0-PhenylbutazoneCCCCC1C(=O)N(N(C1=O)c2ccccc2)c3ccccc3
52-67-5200-148-8-PenicillamineCC(C)(S)[C@@H](N)C(O)=O
54-31-9200-203-6-FurosemideNS(=O)(=O)c1cc(C(=O)O)c(NCc2occc2)cc1Cl
58-71-9200-394-6-Cefalotin SodiumN12[C@@H]([C@@H](NC(Cc3cccs3)=O)C2=O)SCC(=C1C(=O)[O-])COC(C)=O.[Na+]
59-87-0200-443-1JRC-000879NitrofuralNC(=O)N\N=C\c1oc(cc1)[N+](=O)[O-]

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