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It is functionally related to a paracetamol. | Acetaminophen glutathione conjugate is a glutathione derivative. | 0 |
It is a monocarboxylic acid, a C-nitro compound and an aromatic ether. | (2-nitrophenoxy)acetic acid is a monocarboxylic acid comprising acetic acid substituted at the alpha carbon with a 2-nitrophenoxy group. | 0 |
3-(2-iodacetamido)-PROXYL is a member of aminoxyls, a pyrrolidinecarboxamide and an organoiodine compound. | It is functionally related to a PROXYL. | 0 |
It is a metabolite of the polycyclic aromatic hydrocarbon chrysene. | It has a role as a xenobiotic metabolite and a xenoestrogen. | 0 |
It is functionally related to a phloroglucinol. | Eckol is a phlorotannin that is oxanthrene-1,3,6,8-tetrol substituted by a 3,5-dihydroxyphenoxy moiety at position 4. | 0 |
D-alpha-aminobutyric acid is an optically active form of alpha-aminobutyric acid having D-configuration. | It is an alpha-aminobutyric acid and a D-alpha-amino acid. | 0 |
It has a role as an antihypertensive agent and an adrenergic antagonist. | It is a member of guanidines and a spiroketal. | 0 |
It is a member of cyclopentanols, a member of acetamides, a member of guanidines and a 3-hydroxy monocarboxylic acid. | It has a role as an antiviral drug and an EC 3.2.1.18 (exo-alpha-sialidase) inhibitor. | 0 |
It is an organic heteropentacyclic compound, an epoxide, a tertiary alcohol, a gamma-lactone, a diol and a picrotoxane sesquiterpenoid. | Picrotin is an organic heteropentacyclic compound that is picrotoxinin in which the olefinic double bond has undergone addition of water to give the corresponding tertiary alcohol. | 0 |
It contains a 7-hydroxy-8-[(naphthalen-1-yl)diazenyl]naphthalene-1,3-disulfonate. | It has a role as a histological dye. | 0 |
It has a role as an androgen. | Formebolone is a 3-hydroxy steroid and a steroid aldehyde. | 0 |
It is functionally related to a D-xylonic acid. | D-xylono-1,5-lactone is a xylonolactone. | 0 |
It has a role as an anticonvulsant, a teratogenic agent, a drug allergen and a sodium channel blocker. | It is functionally related to a hydantoin. | 0 |
It is functionally related to a (+)-dihydrokaempferol. | It has a role as a metabolite. | 0 |
Bis(N-pantothenylamidoethyl) disulfide is an organonitrogen compound and an organooxygen compound. | It is functionally related to a beta-amino acid. | 0 |
It is an alkadiene, a hemiterpene and a volatile organic compound. | Isoprene is a hemiterpene with the formula CH2=C(CH3)CH=CH2; the monomer of natural rubber and a common structure motif to the isoprenoids, a large class of other naturally occurring compounds. | 0 |
Memantine hydrochloride is a hydrochloride obtained by reaction of memantine with one equivalent of hydrochloric acid. | A low to moderate affinity uncompetitive (open-channel); NMDA receptor antagonist which binds preferentially to the NMDA receptor-operated cation channels. | 0 |
It has a role as a human metabolite and an iron chelator. | Beta-citrylglutamic acid is an N-acyl-L-glutamic acid in which the acyl group is specified as beta-citryl. | 0 |
2,2-dimethylsuccinic acid is an alpha,omega-dicarboxylic acid that is succinic acid substituted by two methyl groups at positions 2 and 2 respectively. | It is a conjugate acid of a 2,2-dimethylsuccinate(2-). | 0 |
It is a 2-oxo monocarboxylic acid, an oxo fatty acid, a medium-chain fatty acid and a straight-chain fatty acid. | It is functionally related to a hexanoic acid. | 0 |
It is functionally related to a podophyllotoxin and a 4'-demethylepipodophyllotoxin. | Etoposide is a beta-D-glucoside, a furonaphthodioxole and an organic heterotetracyclic compound. | 0 |
O-phospho-L-serine is the L-enantiomer of O-phosphoserine. | It has a role as an EC 1.4.7.1 [glutamate synthase (ferredoxin)] inhibitor, a human metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite, an EC 2.5.1.49 (O-acetylhomoserine aminocarboxypropyltransferase) inhibitor, an EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor and a mouse metabolite. | 0 |
Idazoxan is a benzodioxine that is 2,3-dihydro-1,4-benzodioxine in which one of the hydrogens at position 2 has been replaced by a 4,5-dihydro-1H-imidazol-2-yl group. | It is a benzodioxine and a member of imidazolines. | 0 |
It has a role as a vibriostatic agent and an antifolate. | 2,4-diamino-6,7-diisopropylpteridine is a member of the class of pteridines that is pteridine in which the hydrogens at positions 2 and 4 are replaced by amino groups, whilst those at positions 6 and 7 are replaced by isopropyl groups. | 0 |
Ethylene glycol is a 1,2-glycol compound produced via reaction of ethylene oxide with water. | It has a role as a metabolite, a toxin, a solvent and a mouse metabolite. | 0 |
It is functionally related to an androsterone. | It has a role as a human metabolite and a mouse metabolite. | 0 |
(S)-styrene oxide is the (S)-enantiomer of styrene oxide. | It is an enantiomer of a (R)-styrene oxide. | 0 |
It is a cinchona alkaloid and an aromatic ether. | Optochin is a cinchona alkaloid consisting of 10,11-dihydrocinchonan bearing hydroxy and ethoxy substituents at positions 9 and 6' respectively. | 0 |
4-bromo-2-chlorophenol is a halophenol that is phenol in which the hydrogens at positions 2 and 4 have been replaced by chlorine and bromine, respectively. | It is a halophenol, a member of monochlorobenzenes and an organobromine compound. | 0 |
It is a conjugate acid of a N-(5-phosphonato-beta-D-ribosyl)anthranilate. | N-(5-phospho-beta-D-ribosyl)anthranilic acid is a ribose monophosphate and a N-glycosyl compound. | 0 |
It is a conjugate acid of a (S)-2-(4-chloro-2-methylphenoxy)propanoate. | (S)-mecoprop is the (S)-enantiomer of 2-(4-chloro-2-methylphenoxy)propanoic acid; the inactive stereoisomer of the racemic herbicide mecoprop. | 0 |
for use on a wide range of crops including fruit, vegetables and ornamentals. | Boscalid is a pyridinecarboxamide obtained by formal condensation of the carboxy group of 2-chloronicotinic acid with the amino group of 4'-chlorobiphenyl-2-amine. | 0 |
Butane-1,3-diol is a butanediol compound having two hydroxy groups in the 1- and 3-positions. | It is a butanediol and a glycol. | 0 |
It has a role as a pyrethroid ester insecticide. | It is functionally related to a chrysanthemic acid. | 0 |
It exhibits antioxidant, anti-inflammatory, anti-angiogenesis and anti-proliferative properties. | It is a diterpenoid, a member of furans, an organic heteropentacyclic compound, a tertiary alcohol and a primary alcohol. | 0 |
Pinocarvone is a bridged compound resulting from rearrangement of carvone. | It has a role as a mouse metabolite. | 0 |
It has a role as a radiation protective agent, an antioxidant and a drug metabolite. | It is a diamine and an alkanethiol. | 0 |
It is a conjugate base of a L-leucinium. | It is a pyruvate family amino acid, a proteinogenic amino acid, a leucine and a L-alpha-amino acid. | 0 |
By preventing the conversion of levodopa to dopamine in the periphery, it causes an increase in the amount of levodopa reaching the central nervous system and so reduces the required dose. | Benserazide has no antiparkinson actions when given alone. | 0 |
It is a member of azobenzenes, a naphthalenesulfonic acid, a member of naphthols and a member of acetamides. | It is a conjugate acid of a 5-acetamido-4-hydroxy-3-(phenyldiazenyl)naphthalene-2,7-disulfonate. | 0 |
It has a role as a nutraceutical. | Manganese(II) sulfate is a metal sulfate in which the metal component is manganese in the +2 oxidation state. | 0 |
It has a role as an Escherichia coli metabolite and a mouse metabolite. | It is a conjugate acid of a 5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-). | 0 |
It is a tautomer of a D-allothreonine zwitterion. | It is an enantiomer of a L-allothreonine. | 0 |
It derives from a hydride of a 4H-pyran. | It has been isolated from the fungus Aspergillus oryzae. | 0 |
It has a role as an EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor, an angiogenesis inhibitor and an anti-inflammatory agent. | SB220025 is am member of the class of imidazoles carrying piperidin-4-yl, 4-fluophenyl and 2-aminopyrimidin-4-yl substituents at posiitons 1, 4 and 5 respectively. | 0 |
It is a heptanol and a secondary alcohol. | Heptan-2-ol is a secondary alcohol that is heptane substituted by a hydroxy group at position 2. | 0 |
It has a role as an environmental contaminant and a carcinogenic agent. | 2-nitrotoluene is a mononitrotoluene that is toluene carrying a nitro substituent at position 2. | 0 |
N-phenylglycine is a glycine carrying an N-phenyl substituent. | It has a role as an allergen. | 0 |
It has a role as a human blood serum metabolite and a human urinary metabolite. | It is functionally related to a dopamine. | 0 |
Troleandomycin is only found in individuals that have taken the drug. | It has a role as an EC 1.14.13.97 (taurochenodeoxycholate 6alpha-hydroxylase) inhibitor and a xenobiotic. | 0 |
Acid fuchsin (free acid form) is an arenesulfonic acid that is 3-[(4-amino-3-methylphenyl)(4-aminophenyl)methylidene]-6-iminocyclohexa-1,4-diene-1-sulfonic acid in which the hydrogens ortho to the amino functions are replaced by phenyl groups. | It is an arenesulfonic acid, an imine and a primary arylamine. | 0 |
It has a role as an EC 3.2.1.24 (alpha-mannosidase) inhibitor, a bacterial metabolite and an EC 3.2.1.114 (mannosyl-oligosaccharide 1,3-1,6-alpha-mannosidase) inhibitor. | Mannostatin A is an amino cyclitol that is cyclopentane substituted by hydroxy groups at positions 1, 2 and 3, by an amino group at positon 4, and by a methylsulfanediyl group at position 5 (the 1R,2R,3R,4S,5R-stereoisomer). | 0 |
Dentatin is a member of coumarins. | It has a role as a metabolite. | 0 |
Lupeol acetate is an organic molecular entity. | It has a role as a metabolite. | 0 |
P-toluic acid is a methylbenzoic acid in which the methyl substituent is located at position 4. | It is a conjugate acid of a p-toluate. | 0 |
Tridec-1-ene-3,5,7,9,11-pentayne is a pentayne that is tridecane which carries a double bond at position 1 and triple bonds at positions 3,5,7,9 and 11. | It is an enyne, a pentayne, an acyclic acetylene and an acyclic olefin. | 0 |
It is a member of pyrimidoquinolines and a ribitol phosphate. | It is a conjugate acid of a coenzyme gamma-F420-2(5-) and a coenzyme gamma-F420-2(4-). | 0 |
Lychnostatin 2 is a germacranolide isolated from Lychnophora antillana and has been shown to exhibit antineoplastic activity. | It has a role as a metabolite and an antineoplastic agent. | 0 |
Diallyl trisulfide is an organic trisulfide that is trisulfane in which both of the hydrogens are replaced by allyl groups. | A component of the essential oil of garlic and a major component of the traditional Chinese medicine allitridium, it exhibits antifungal, antitumour and antioxidant activity It has a role as an apoptosis inducer, an estrogen receptor antagonist, an antineoplastic agent, a vasodilator agent, an antioxidant, an anti-inflammatory agent, an insecticide, an antiprotozoal drug, a platelet aggregation inhibitor and an antilipemic drug. | 0 |
It is a uridine 5'-phosphate and a pyrimidine ribonucleoside 5'-monophosphate. | It is a conjugate acid of a uridine 5'-monophosphate(2-). | 0 |
Dihydrolipoic acid is a thio-fatty acid that is reduced form of lipoic acid. | It has a role as a neuroprotective agent, an antioxidant and a human metabolite. | 0 |
It is a N-acetyl-L-amino acid, a N(2)-acyl-L-glutamine and a N(2)-acetylglutamine. | It is a conjugate acid of a N-acetyl-L-glutaminate. | 0 |
Azetidine-2-carboxylic acid is an azetidinecarboxylic acid that is azetidine substituted by a carboxy group at position 2. | It has a role as a plant metabolite and a teratogenic agent. | 0 |
It is a member of phenothiazines, a tertiary amine, a methyl ketone and an aromatic ketone. | It has a role as an anxiolytic drug, a sedative and a histamine antagonist. | 0 |
5-hydroxyimidazole-4-acetic acid is a hydroxyimidazole that is 5-hydroxyimidazole in which the hydrogen at position 4 is replaced by a carboxymethyl group. | It is a conjugate acid of a 5-hydroxyimidazole-4-acetate. | 0 |
Cefaclor is a cephalosporin bearing chloro and (R)-2-amino-2-phenylacetamido groups at positions 3 and 7, respectively, of the cephem skeleton. | It has a role as an antibacterial drug and a drug allergen. | 0 |
It is functionally related to a malonic acid. | It is a dicarboxylic acid and a dicarboxylic fatty acid. | 0 |
A synthetic antibacterial which is used for the treatment of urinary tract and intestinal infections. | It is a quinolone antibiotic, a member of pyrrolidines, a tertiary amino compound, a monocarboxylic acid and a pyridopyrimidine. | 0 |
It has a role as a cytochrome-b6f complex inhibitor. | Dibromothymoquinone is a member of 1,4-benzoquinones. | 0 |
It is a conjugate acid of a lutidinate(1-). | Lutidinic acid is a pyridinedicarboxylic acid carrying carboxy groups at positions 2 and 4. | 0 |
N(6)-hydroxy-L-lysine is the N(6)-hydroxy derivative of L-lysine. | It is a hydroxy-L-lysine and a N-hydroxy-alpha-amino-acid. | 0 |
Ingenol is a tetracyclic diterpenoid that is 1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one substituted at positions 5, 5a and 6 by hydroxy groups, positions 1, 1, 7 and 9 by methyl groups, position 4 by a hydroxymethyl group and position 1 by an oxo group (the 1aR,2S,5R,5aR,6S,8aS,9R,10aR diastereomer). | It is a tetracyclic diterpenoid and a cyclic terpene ketone. | 0 |
It is an ortho-fused polycyclic arene and a member of tetraphenes. | Tetraphene is an angular ortho-fused polycyclic arene consisting of four fused benzene rings. | 0 |
It is an iodoamino acid, a non-proteinogenic L-alpha-amino acid and a L-histidine derivative. | 5-iodo-L-histidine is an iodoamino acid that is L-histidine derivative in which the imidazole ring is substituted by iodine at position 5. | 0 |
5alpha-androst-16-en-3alpha-ol is a 3alpha-sterol. | It derives from a hydride of a 5alpha-androst-16-ene. | 0 |
It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an acaricide, an agrochemical and a nematicide. | Triazophos is an organic thiophosphate and an organothiophosphate insecticide. | 0 |
It is an anthocyanin cation and a beta-D-glucoside. | It is functionally related to a cyanidin cation. | 0 |
It is a vitamin B3, a pyridinecarboxamide and a pyridine alkaloid. | It has a role as an EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor, a metabolite, a cofactor, an antioxidant, a neuroprotective agent, an EC 3.5.1.98 (histone deacetylase) inhibitor, an anti-inflammatory agent, a Sir2 inhibitor, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite, a mouse metabolite, a human urinary metabolite and a geroprotector. | 0 |
It is a conjugate acid of a 1H-imidazole. | Imidazolium cation is an imidazolium ion that is the cation resulting from protonation at the 3-position of 1H-imidazole. | 0 |
It is a member of cystathionines and a selenoamino acid. | Selenocystathionine is a member of the class of cystathionines derived from homoselenocysteine and serine residues joined by a selenide bond. | 0 |
It has a role as a metabolite, a marine metabolite and a fungal metabolite. | O-orsellinic acid is a dihydroxybenzoic acid that is 2,4-dihydroxybenzoic acid in which the hydrogen at position 6 is replaced by a methyl group. | 0 |
3-allyl-2-hydroxybenzoic acid is a hydroxybenzoic acid. | It is functionally related to a salicylic acid. | 0 |
It is a conjugate acid of a propane-2-sulfonate. | Propane-2-sulphonic acid is an alkanesulfonic acid in which the sulfonic acid group is attached to a propan-2-yl group. | 0 |
DT(6-4)T is a single-stranded DNA oligonucleotide consisting of two thymidine molecules linked (3'->5') and also with a C6-C4 bond. | It results from irradiation at 254 nm of normal dTpT (PDB entry: 1EHL). | 0 |
It is a polyketide and a tetrahydroxyanthraquinone. | It is a conjugate acid of a norsolorinate(1-). | 0 |
3-O-methyl-D-glucose is a D-aldohexose that is D-glucose in which the hydrogen of the hydroxy group at position 3 has been substituted by a methyl group. | It is functionally related to an aldehydo-D-glucose. | 0 |
A non-systemic fungicide first introduced in the 1960s, it is used to control a range of diseases in a wide variety of crops. | It has a role as an antifungal agrochemical. | 0 |
It is a D-galactose and a galactopyranose. | It has a role as an Escherichia coli metabolite and a mouse metabolite. | 0 |
(7R,8S)-7,8-diaminononanoic acid is the isomer of 7,8-diaminononanoic acid having (R)- and (S)- configurations at C-7 and C-8, respectively; an intermediate in the biosynthetic pathway of biotin. | It is a conjugate acid of a (7R,8S)-7,8-diammoniononanoate. | 0 |
It has a role as a human metabolite and a mouse metabolite. | L-gulono-1,4-lactone is the furanose form of gulonolactone having L-configuration. | 0 |
It is a conjugate acid of an azide anion. | Hydrogen azide is a nitrogen hydride. | 0 |
It is a member of phenols, a primary alpha-hydroxy ketone and a dihydroxyacetophenone. | 2,4'-dihydroxyacetophenone is a dihydroxyacetophenone that is ethanone substituted by a hydroxy group at position 2 and a 4-hydroxyphenyl group at position 1. | 0 |
It derives from a hydride of an estrane. | Hydroxystenozole is a steroid. | 0 |
It is functionally related to an acetophenone. | 4-acetoxy acetophenone is a methyl ketone that is acetophenone substituted by an acetoxy group at position 4. | 0 |
It is an aromatic ether, a member of phenylureas and a member of monochlorobenzenes. | It is a phenylurea herbicide used for the control of annual grasses, mosses and broad-leaved weeds. | 0 |
(3S)-3-hydroxy-3-methylglutaryl-CoA is a 3-hydroxy-3-methylglutaryl-CoA where the 3-hydroxy-3-methylglutaryl component has (S)-configuration. | It has a role as a human metabolite and a mouse metabolite. | 0 |
Diethylstilbestrol is an olefinic compound that is trans-hex-3-ene in which the hydrogens at positions 3 and 4 have been replaced by p-hydroxyphenyl groups. | It is a polyphenol and an olefinic compound. | 0 |
It is a potent histamine releaser and may serve as an inflammatory mediator. | It has a role as a human metabolite and a histamine releasing agent. | 0 |
It is functionally related to a D-glyceric acid. | 2-phospho-D-glyceric acid is a 2-phosphoglyceric acid in which the glyceric acid moiety has D (R) configuration. | 0 |
It is a carbamate ester and a monocarboxylic acid amide. | It has a role as a xenobiotic, an environmental contaminant and a herbicide. | 0 |
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