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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  excel file 
CASEINECSChemical NameSMILES
599-79-1 209-974-3SalazosulfapyridineOC(=O)c1cc(ccc1O)N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3
60-56-0 200-482-4Thiamazole[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
6055-19-2 Cyclophosphamide (Hydrated)C1CNP(=O)(OC1)N(CCCl)CCCl.O
61-68-7 200-513-1Mefenamic Acidc1(c(cccc1)C(=O)O)Nc1c(c(ccc1)C)C
62-44-2 200-533-0PhenacetinCCOc1ccc(NC(=O)C)cc1
62-55-5 200-541-4ThioacetamideCC(=S)N
62571-86-2 263-607-1CaptoprilC[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O
64-17-5 200-578-6EthanolC(C)O
64-75-5 200-593-8Tetracycline HydrochlorideCl.[H][C@@]12C[C@@]3([H])C(C(=O)C4=C(O)C=CC=C4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C)C
64-77-7 200-594-3TolbutamideCCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1
64-86-8 200-598-5ColchicineCOC1=C(OC)C(OC)=C2C(CC[C@H](NC(C)=O)C3=CC(=O)C(OC)=CC=C23)=C1
65277-42-1 265-667-4KetoconazoleCC(=O)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=CN=C3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1
66357-59-3 266-333-0N-[2-[[5-[(Dimethylamino)Methyl]Furfuryl]Thio]Ethyl]-N'-Methyl-2-Nitrovinylidenediamine HydrochlorideCl.c1(oc(CSCCN\C(=C\[N+](=O)[O-])NC)cc1)CN(C)C
67-20-9 200-646-5Nitrofurantoinc1cc(oc1/C=N/N2CC(=O)NC2=O)[N+](=O)[O-]
67-21-0 200-647-0Dl-2-Amino-4-(Ethylthio)Butyric AcidCCSCCC(N)C(=O)O
6724-53-4 229-775-52-(2,2-Dicyclohexylethyl)Piperidinium Hydrogen MaleateC1(CCCCC1)C(C1CCCCC1)C[C@@H]1NCCCC1.C(\C=C/C(=O)O)(O)=O
68-90-6 200-695-2BenziodaroneCCc1oc2ccccc2c1C(=O)c3cc(I)c(O)c(I)c3
69-09-0 200-701-3Chlorpromazine HydrochlorideN1(c2c(Sc3c1cccc3)ccc(c2)Cl)CCCN(C)C.Cl
70374-39-9 Lornoxicamc12c(S(N(C)C(=C1O)C(Nc1ccccn1)=O)(=O)=O)cc(s2)Cl
71125-38-7 615-253-82h-1,2-Benzothiazine-3-Carboxamide, 4-Hydroxy-2-Methyl-N-(5-Methyl-2-Thiazolyl)-, 1,1-DioxideCN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3ncc(C)s3
73590-58-6 615-996-81h-Benzimidazole, 6-Methoxy-2-[[(4-Methoxy-3,5-Dimethyl-2-Pyridinyl)Methyl]Sulfinyl]-COc1ccc2nc([nH]c2c1)S(=O)Cc3ncc(C)c(OC)c3C
76095-16-4 278-375-7(S)-1-[N-[1-(Ethoxycarbonyl)-3-Phenylpropyl]-L-Alanyl]-L-Proline MaleateN1(CCC[C@H]1C(O)=O)C([C@@H](N[C@H](CCc1ccccc1)C(OCC)=O)C)=O.OC(\C=C/C(O)=O)=O
76824-35-6 616-396-9Propanimidamide, 3-[[[2-[(Aminoiminomethyl)Amino]-4-Thiazolyl]Methyl]Thio]-N-(Aminosulfonyl)-NC(=N)Nc1nc(CSCCC(=N)NS(=O)(=O)N)cs1
78628-80-5 616-640-41-Naphthalenemethanamine, N-[(2e)-6,6-Dimethyl-2-Hepten-4-Yn-1-Yl]-N-Methyl-, Hydrochloride (1:1)CN(C\C=C\C#CC(C)(C)C)Cc1cccc2ccccc12
79902-63-9 616-751-8Butanoic Acid, 2,2-Dimethyl-, (1s,3r,7s,8s,8ar)-1,2,3,7,8,8a-Hexahydro-3,7-Dimethyl-8-[2-[(2r,4r)-Tetrahydro-4-Hydroxy-6-Oxo-2h-Pyran-2-Yl]Ethyl]-1-Naphthalenyl EsterCCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
80-77-3 201-307-4ChlormezanoneCN1C(c2ccc(Cl)cc2)S(=O)(=O)CCC1=O
86483-48-9 Ciprofloxacin HydrochlorideN1CCN(CC1)c1c(F)cc2c(n(cc(c2=O)C(O)=O)C2CC2)c1.Cl
91-40-7 202-066-8N-Phenylanthranilic AcidOC(=O)c1ccccc1Nc2ccccc2
91-64-5 202-086-7Coumarinc12c(ccc(o1)=O)cccc2
94-20-2 202-314-5ChlorpropamideCCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1
964-52-3 213-519-4Moxisylyte Hydrochloridec1(c(cc(C)c(c1)OC(C)=O)OCC[NH+](C)C)C(C)C.[ClH-]
97-77-8 202-607-8DisulfiramCCN(CC)C(=S)SSC(=S)N(CC)CC
Records:101:132 Back