ChemTEB Pair Classification Datasets
Collection
Chemical Pair Classification Datasets for Evaluating Text Embedding Models
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10 items
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Updated
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title
stringlengths 4
182
| synonyms
stringlengths 2
329
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1
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|---|---|---|
Nadifloxacin
|
9-Fluoro-6,7-dihydro-8-(4-hydroxy-1-piperidinyl)-5-methyl-1-oxo-1H,5H-benzo[ij]quinolizine-2-carboxylic Acid
| 1
|
Ethanol
|
Art Naturals
| 1
|
Digalacturonic acid
|
alpha-D-galactopyranuronosyl-(1->4)-D-galactopyranuronic acid
| 1
|
Carbendazim
|
Equitdazin
| 1
|
Isovaleric acid
|
DELPHINIC-ACID
| 1
|
Methantheline
|
Methanthelinum
| 1
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Climbazole
|
1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one
| 1
|
4-Ethyl-2-methoxyphenol
|
4-Ethyl-2-methoxy phenol
| 1
|
Adipic Acid
|
adipic acid
| 1
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Diisopropylethylamine
|
N-ethyldiiso-propyl-amine
| 1
|
1,3-Diphenylguanidine
|
Melaniline
| 1
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Desthiobiotin
|
6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoic acid
| 1
|
2-Butyne-1,4-diol
|
1,4-Dimethoxyacetylene
| 1
|
Promoxolane
|
WLN: T5O COTJ BY1&1 BY1&1 D1Q
| 1
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Iproniazid
|
Marsilid
| 1
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Diazepam
|
DIAZEPAM (IARC)
| 1
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Ractopamine
|
BENZENEMETHANOL, 4-HYDROXY-.ALPHA.-(((3-(4-HYDROXYPHENYL)-1-METHYLPROPYL)AMINO)METHYL)-
| 1
|
Helium
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HELIUM [WHO-DD]
| 1
|
2-Fluoro-5-hydroxy-L-tyrosine
|
L-Tyrosine, 2-fluoro-5-hydroxy-
| 1
|
Dihydroergotamine
|
Ergotamine, 9,10-dihydro-
| 1
|
Trolnitrate phosphate
|
TROLNITRATE PHOSPHATE [MART.]
| 1
|
2-Hydroxyethyl phosphate
|
2-hydroxyethyl dihydrogen phosphate
| 1
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Triclocarban
|
DG BodyAntibacterial Deodorant 3.5 oz bar
| 1
|
Carbon Disulfide
|
Dithioxomethane
| 1
|
Cladribine
|
6-amino-2-chloro-9-(2-deoxy-beta-D-erythro-pentofuranosyl)purine
| 1
|
2-Chloro-p-phenylenediamine sulfate
|
2-chlorobenzene-1,4-diamine;sulfuric acid
| 1
|
2,4,6-Trinitrotoluene
|
2,4,6-TRINITROTOLUENE
| 1
|
Tedisamil
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TEDISAMIL [WHO-DD]
| 1
|
Meclizine Hydrochloride
|
Bonamine
| 1
|
Iridium
|
Iridium, wire reel, 0.2m, diameter 1.0mm, as drawn, 99.9%
| 1
|
Maprounic acid
|
3-Hydroxyurs-12-en-29-oic acid
| 1
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Decahydronaphthalene
|
Decalin(R)
| 1
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Phenylpropanolamine
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1S,2R-PHENYLPROPANOLAMINE HYDROCHLORIDE
| 1
|
Tridihexethyl bromide
|
3-cyclohexyl-N,N,N-triethyl-3-hydroxy-3-phenylpropan-1-aminium bromide
| 1
|
Edaravone
|
EDARAVONE [MART.]
| 1
|
Tanshinone I
|
Tanshinone
| 1
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Dibucaine
|
Nupercainal
| 1
|
alpha-Cotonefuran
|
3,4,6-trimethoxydibenzo[b,d]furan-2,7-diol
| 1
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Isovalerylalanine
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N-Isovalerylalanine
| 1
|
Sodium Monofluorophosphate
|
Disodiummonofluorophosphate
| 1
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Laminine
|
Laminine
| 1
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Pyridoxal phosphate hydrate
|
3-Hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinecarboxaldehyde monohydrate
| 1
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Batyl alcohol
|
3-(Octadecyloxy)-1,2-propanediol
| 1
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4-(Trifluoromethyl)phenol
|
4-(trifluoromethyl)phenyl alcohol
| 1
|
6-Methylmercaptopurine riboside
|
Purine-6-thiol, 6-methyl-9-ribofuranosyl-
| 1
|
12alpha-Hydroxyprogesterone
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12.ALPHA.-HYDROXYPROGESTERONE
| 1
|
(1S,2S)-1,2-dihydronaphthalene-1,2-diol
|
trans-1,2-Dihydronaphthalene-1,2-diol
| 1
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1,2,3,4,7,8,9-Heptachlorodibenzofuran
|
1,2,3,4,7,8,9-HpCDF
| 1
|
Sennoside B
|
(9R,9'S)-5,5'-bis(beta-D-glucopyranosyloxy)-4,4'-dihydroxy-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2,2'-dicarboxylic acid
| 1
|
Roxindole
|
roxindol
| 1
|
(+)-8-epi-Altholactone
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(+)-8-epi-Altholactone
| 1
|
(Methylthio)acetic acid
|
2-methylsulfanylacetic acid
| 1
|
Phosmet
|
S-PHTHALIMIDOMETHYL O,O-DIMETHYL PHOSPHORODITHIOATE
| 1
|
Paramethasone
|
Dillar
| 1
|
5alpha-Androstan-2-en-17beta-ol
|
Androst-2-en-17-ol
| 1
|
Triiodothyronine sulfate
|
3,5,3'-Triiodo-L-thyronine 4'-O-sulphate
| 1
|
gamma-Heptalactone
|
5-propyldihydrofuran-2(3h)-one
| 1
|
Sulfadiazine
|
Thi-Di-Mer
| 1
|
Doramapimod
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Doramapimod (USAN/INN)
| 1
|
4'-Hydroxydiclofenac
|
Diclofenac-4-hydroxy
| 1
|
Cyclobenzaprine
|
Ciclobenzaprina (INN-Spanish)
| 1
|
Hexachlorobenzene
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NO Bunt liquid
| 1
|
Azelastine Hydrochloride
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Azelastine Hydrochloride 1.0 mg/ml in Methanol (as free base)
| 1
|
Glutathione
|
GLUTATHIONE [MART.]
| 1
|
Antibiotic Bu 2545
|
N-[2-methoxy-1-(3,4,5-trihydroxy-6-methylsulanyloxan-2-yl)propyl]-1-methylpyrrolidine-2-carboxamide
| 1
|
17-Hydroxyandrost-4-en-3-one
|
17-Hydroxy-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthren-3-one(testosterone)
| 1
|
1-Hydroxyisoquinoline
|
InChI=1/C9H7NO/c11-9-8-4-2-1-3-7(8)5-6-10-9/h1-6H,(H,10,11
| 1
|
Tantalum
|
Tantalum, foil, 0.5m coil, thickness 0.03mm, coil width 1.2mm, annealed, 99.9%
| 1
|
D-Psicose
|
D-Psicopyranoside
| 1
|
Dexetimide
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(+)-Benzetimide
| 1
|
3-O-Acetylpinobanksin
|
rac-Pinobanksin Acetate
| 1
|
Doxylamine Succinate
|
DIMETHYLAMINOETHOXYMETHYLBENZYLPYRIDINE SUCCINATE
| 1
|
Angiotensin IV
|
Angiotensin II (3-8), human
| 1
|
Ciprofloxacin
|
CIPROFLOXACIN (USP-RS)
| 1
|
N-Acetylhistamine
|
N-[2-(1H-Imidazol-4-yl)ethyl]acetamide #
| 1
|
Hydralazine Hydrochloride
|
1(2H)-Phthalazinone, hydrazone, hydrochloride
| 1
|
Dibenzyl disulfide
|
Benzyl disulfide, 8CI
| 1
|
Dimethylphenylpiperazinium
|
Piperazinium, 1,1-dimethyl-4-phenyl-
| 1
|
Chromic acid
|
tetraoxochromic acid
| 1
|
Lanthanum
|
La(2+)
| 1
|
2-(Methylthio)ethanol
|
2-(METHYLTHIO)ETHANOL [FHFI]
| 1
|
1,3-Dinitroglycerin
|
2-hydroxypropane-1,3-diyl dinitrate
| 1
|
2H-Chromene
|
1,2-Benzopyran
| 1
|
Isotanshinone IIB
|
Isotanshinone IIB
| 1
|
2-Hydroxypiperitone
|
2-Hydroxypiperitone
| 1
|
Tetracaine Hydrochloride
|
2-(Dimethylamino)ethyl p-(butylamino)benzoate monohydrochloride
| 1
|
4'-Hydroxyacetophenone
|
4''-hydroxyacetophenone
| 1
|
Sulfometuron-methyl
|
SULFOMETURON-METHYL [MI]
| 1
|
Picric Acid
|
Pikrinsaeure [German]
| 1
|
Phosphothiophosphoric acid-adenylate ester
|
Adenosine 5'-(trihydrogen diphosphate), P'-anhydride with phosphorothioic acid (9CI)
| 1
|
Barium acetate
|
Octan barnaty [Czech]
| 1
|
2-Aminotetradecanoic acid
|
2-aminotetradecanoic acid
| 1
|
Bombykol
|
LZT8R8TVZ7
| 1
|
n-(5-Aminopentyl)acetamide
|
Monoacetylcadaverine
| 1
|
Gliquidone
|
ARDF-26
| 1
|
Ethylene Glycol
|
FC72KVT52F
| 1
|
Cetraxate
|
Cetraxate [INN]
| 1
|
Tramiprosate
|
3-amino-1-propane sulfonic acid
| 1
|
2,2',4,4',6,6'-Hexachlorobiphenyl
|
HEXACHLOROBIPHENYL, 2,4,6,2',4',6'-
| 1
|
(2S)-2-Hydroxybutanedioic acid
|
(S)-Hydroxybutanedioate
| 1
|
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PubChem Synonyms Pair Classification
This dataset consists of pairs of chemical entity names and their corresponding synonyms, with labels indicating whether they refer to the same entity. A label of 1 means the name and synonym correspond to the same chemical entity, while a label of 0 indicates they refer to different entities. The dataset is sourced from PubChem (ChEBI), providing a valuable resource for tasks involving synonym resolution and chemical entity matching.
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