AIM-Harvard/TrialPanorama-filtered huggingface dataset:
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
UniProt: Q50565 (Q50565_METTH)
Organism: Methanothermobacter thermautotrophicus (strain ATCC 29096 / DSM 1053 / JCM 10044 / NBRC 100330 / Delta H)
Activity: Ki = 4.92
Assay: Inhibitory activity against beta carbonic anhydrase (Cab) from Methanobacterium thermoautotrophicum
Drug: acetazolamide
Target: Carbonic anhydrase 13 (Enzyme)
Gene: CA13
UniProt: Q8N1Q1 (CAH13_HUMAN)
Organism: Homo sapiens
Activity: Ki = 8.24
Assay: Inhibition of human recombinant carbonic anhydrase 13 preincubated for 15 mins by CO2 hydration method
Drug: acetazolamide
Target: Carbonic anhydrase 15 (Enzyme)
Gene: Ca15
UniProt: Q99N23 (CAH15_MOUSE)
Organism: Mus musculus
Activity: Ki = 7.14
Assay: Inhibition of mouse recombinant carbonic anhydrase 15 by stopped-flow CO2 hydrase assay
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
Gene: NCE103
UniProt: P53615 (CAN_YEAST)
Organism: Saccharomyces cerevisiae (strain ATCC 204508 / S288c)
Activity: Ki = 7.09
Assay: Inhibition of Saccharomyces cerevisiae beta-carbonic anhydrase preincubated for 15 mins by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
Gene: NCE103
UniProt: Q5AJ71 (CAN_CANAL)
Organism: Candida albicans (strain SC5314 / ATCC MYA-2876)
Activity: Ki = 7.4
Assay: Inhibition of Helicobacter pylori beta-carbonic anhydrase by stopped-flow CO2 hydration assay
Drug: acetazolamide
Target: Probable transmembrane carbonic anhydrase (Carbonate dehydratase) (Carbonic dehydratase); Transmembrane carbonic anhydrase (Enzyme)
UniProt: P96878 (P96878_MYCTU)
Organism: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Activity: Ki = 7.92
Assay: Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv3273 by by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
UniProt: Q6FTL6 (Q6FTL6_CANGA)
Organism: Candida glabrata (strain ATCC 2001 / CBS 138 / JCM 3761 / NBRC 0622 / NRRL Y-65)
Activity: Ki = 7.96
Assay: Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Alpha carbonic anhydrase (Enzyme)
Gene: CA
UniProt: B5SU02 (B5SU02_9CNID)
Organism: Stylophora pistillata
Activity: Ki = 7.8
Assay: Inhibition of cloned Stylophora pistillata alpha-CA expressed in human HEK293 cells by stopped-flow CO2 assay
Drug: acetazolamide
Target: Endochitinase (Enzyme)
Gene: CTS1
UniProt: P29029 (CHIT_YEAST)
Organism: Saccharomyces cerevisiae (strain ATCC 204508 / S288c)
Activity: Ki = 4.68
Assay: Inhibition of Saccharomyces cerevisiae CTS1
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
Gene: CA2
UniProt: C0IX24 (C0IX24_9CNID)
Organism: Stylophora pistillata
Activity: Ki = 7.13
Assay: Inhibition of Stylophora pistillata carbonic anhydrase 2 by stopped-flow CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase 2 (Enzyme)
Gene: CAN2
UniProt: Q3I4V7 (Q3I4V7_CRYNV)
Organism: Cryptococcus neoformans var. grubii
Activity: Ki = 8
Assay: Inhibition of Cryptococcus neoformans recombinant Can2 beta-carbonic anhydrase after 15 mins by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
Gene: ca
UniProt: Q2PCB5 (Q2PCB5_DICLA)
Organism: Dicentrarchus labrax
Activity: Ki = 5.24
Assay: Inhibition of Dicentrarchus labrax CA using 4-nitrophenylacetate substrate by esterase assay
Drug: acetazolamide
Target: Astrosclerin-3 (Enzyme)
UniProt: A6YCJ1 (A6YCJ1_9METZ)
Organism: Astrosclera willeyana
Activity: Ki = 7.29
Assay: Inhibition of GST-tagged astrosclera willeyana Astrosclerin-3 expressed in Escherichia coli after 15 mins preincubation by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Beta-carbonic anhydrase 1 (Enzyme)
Gene: mtcA1
UniProt: P9WPJ7 (MTCA1_MYCTU)
Organism: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Activity: Ki = 6.6
Assay: Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv1284 by by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Delta carbonic anhydrase (Unclassified)
Gene: ca1
UniProt: Q5U9J1 (Q5U9J1_THAWE)
Organism: Thalassiosira weissflogii
Activity: Ki = 7.08
Assay: Inhibition of Thalassiosira weissflogii delta carbonic anhydrase preincubated for 15 mins by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase 2 (Enzyme)
Gene: mtcA2
UniProt: P9WPJ9 (MTCA2_MYCTU)
Organism: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Activity: Ki = 8.05
Assay: Inhibition of full length Mycobacterium tuberculosis H37Rv recombinant carbonic anhydrase 2 encoded by RV3588c by stopped flow CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase 2 (Enzyme)
Gene: CA2
UniProt: P00921 (CAH2_BOVIN)
Organism: Bos taurus
Activity: IC50 = 6.02
Assay: Inhibition of bovine erythrocyte carbonic anhydrase 2 using p-nitrophenyl acetate as substrate preincubated for 10 mins before substrate addition measured after 30 mins by spectrophotometric analysis
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
Gene: CA12|CA1|CA2|CA3|CA4|CA6|CA5A|CA7|CA9|CA13|CA14|CA5B
UniProt: O43570|P00915|P00918|P07451|P22748|P23280|P35218|P43166|Q16790|Q8N1Q1|Q9ULX7|Q9Y2D0 (CAH12_HUMAN|CAH1_HUMAN|CAH2_HUMAN|CAH3_HUMAN|CAH4_HUMAN|CAH6_HUMAN|CAH5A_HUMAN|CAH7_HUMAN|CAH9_HUMAN|CAH13_HUMAN|CAH14_HUMAN|CAH5B_HUMAN)
Organism: Homo sapiens
Activity: Ki = 9.1
Assay: Compound was evaluated for the inhibition of Carbonic anhydrase (Non competitive)
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
Gene: CA2|CA6|CA3|CA4
UniProt: P00921|P18915|Q3SZX4|Q95323 (CAH2_BOVIN|CAH6_BOVIN|CAH3_BOVIN|CAH4_BOVIN)
Organism: Bos taurus
Activity: IC50 = 7.8
Assay: In vitro concentration that causes 50% inhibition of carbonic anhydrase carbonate hydro-lyase (EC.4.2.1.1) isolated from bovine erythrocyte
Drug: acetazolamide
Target: Carbonic anhydrase V (Enzyme)
Gene: CA5A|CA5B
UniProt: P35218|Q9Y2D0 (CAH5A_HUMAN|CAH5B_HUMAN)
Organism: Homo sapiens
Activity: Ki = 8.74
Assay: Mean inhibitory constant towards human carbonic anhydrase V determined by spectrophotometric dansylamide binding assay
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
UniProt: P46510 (CAHX_FLABI)
Organism: Flaveria bidentis
Activity: Ki = 7.57
Assay: Inhibition of Flaveria bidentis recombinant CA by CO2 hydration assay
Drug: acetazolamide
Target: Carbonic anhydrase 3 (Enzyme)
Gene: CA3
UniProt: Q3SZX4 (CAH3_BOVIN)
Organism: Bos taurus
Activity: Ki = 4.08
Assay: Inhibition of bovine carbonic anhydrase 3 using 4-nitrophenylacetate as substrate after 3 mins using spectrophotometry by Lineweaver-Burk plot analysis
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
UniProt: Q5TU56 (Q5TU56_ANOGA)
Organism: Anopheles gambiae
Activity: Ki = 7.56
Drug: acetazolamide
Target: Carbonic anhydrase (Enzyme)
UniProt: Q9HVB9 (Q9HVB9_PSEAE)
Organism: Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1)
Activity: Ki = 7.12
Drug: acetazolamide
Target: Carbonic anhydrase, alpha family (Unclassified)
UniProt: Q31FD6 (Q31FD6_HYDCU)
Organism: Hydrogenovibrio crunogenus (strain XCL-2)
Activity: Ki = 8.37
Assay: Inhibition of recombinant Thiomicrospira crunogena XCL-2 carbonic anhydrase by stopped flow CO2 hydrase assay
Drug: acetazolamide
Target: Carbonate dehydratase (Enzyme)
UniProt: B2V8E3 (B2V8E3_SULSY)
Organism: Sulfurihydrogenibium sp. (strain YO3AOP1)
Activity: Ki = 8.35
Assay: Inhibition of recombinant Sulfurihydrogenibium yellowstonense YO3AOP1 carbonic anhydrase by stopped flow CO2 hydrase assay
Drug: acetazolamide
Target: Carbonic anhydrase-related protein 11 (Enzyme)
Gene: CA11
UniProt: O75493 (CAH11_HUMAN)
Organism: Homo sapiens
Activity: Ki = 8.24
Assay: Inhibition of recombinant human membrane bound carbonic anhydrase 11 expressed in Escherichia coli pretreated for 15 mins prior to testing by stopped-flow assay
Drug: acetohexamide
Target: Sulfonylurea receptor 1, Kir6.2 (Ion channel)
Gene: ABCC8|KCNJ11
UniProt: Q09428|Q14654 (ABCC8_HUMAN|KCJ11_HUMAN)
Organism: Homo sapiens
Activity: Ki = 4.639
Action type: BLOCKER
Assay: displacement of [3H]glyburide binding in HEK-293 cells expressing hSUR1-hKir6.2
Drug: acetohydroxamic acid
Target: Carbonic anhydrase 2 (Enzyme)
Gene: CA2
UniProt: P00918 (CAH2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.33
Assay: Inhibitory activity against carbonic anhydrase II
Drug: acetohydroxamic acid
Target: Bacterial urease (Enzyme)
Gene: ureA|ureB|ureC
UniProt: Q03282|Q03283|Q03284 (URE3_ECOLX|URE2_ECOLX|URE1_ECOLX)
Organism: Escherichia coli
Action type: INHIBITOR
Assay: Mechanism of Action; CHEMBL2364683; PROTEIN COMPLEX
Drug: acetohydroxamic acid
Target: Urease (Enzyme)
UniProt: P07374 (UREA_CANEN)
Organism: Canavalia ensiformis
Activity: IC50 = 4.76
Assay: Inhibition of jack bean urease
Drug: acetohydroxamic acid
Target: Urease subunit beta (Enzyme)
Gene: ureB
UniProt: Q0PXQ5 (Q0PXQ5_HELPX)
Organism: Helicobacter pylori
Activity: IC50 = 4.76
Assay: Inhibition of Helicobacter pylori urease after 50 mins by indophenol method
Drug: acetophenazine
Target: D(2) dopamine receptor (GPCR)
Gene: DRD2
UniProt: P14416 (DRD2_HUMAN)
Organism: Homo sapiens
Action type: ANTAGONIST
Drug: acetophenazine
Target: Androgen receptor (Transcription factor)
Gene: Ar
UniProt: P15207 (ANDR_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.1
Assay: Displacement of [3H]mibolerone from rat androgen receptor
Drug: racecadotril
Target: Angiotensin-converting enzyme (Enzyme)
Gene: ACE
UniProt: P12821 (ACE_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.5
Drug: racecadotril
Target: Neprilysin (Enzyme)
Gene: MME
UniProt: P08473 (NEP_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 9
Action type: INHIBITOR
Assay: Inhibition of human NEP-mediated amyloid beta hydrolysis
Drug: racecadotril
Target: Angiotensin-converting enzyme (Enzyme)
Gene: ACE
UniProt: P12822 (ACE_RABIT)
Organism: Oryctolagus cuniculus
Activity: IC50 = 6.38
Drug: racecadotril
Target: Neprilysin (Enzyme)
Gene: Mme
UniProt: P07861 (NEP_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 8.32
Drug: racecadotril
Target: Neprilysin (Enzyme)
Gene: MME
UniProt: P08049 (NEP_RABIT)
Organism: Oryctolagus cuniculus
Activity: IC50 = 8.4
Drug: racecadotril
Target: Neprilysin (Enzyme)
Gene: MME
UniProt: P19621 (NEP_PIG)
Organism: Sus scrofa
Activity: IC50 = 8.21
Drug: racecadotril
Target: Endothelin-converting enzyme 1 (Enzyme)
Gene: ECE1
UniProt: P42892 (ECE1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 8.1
Drug: racecadotril
Target: Thermolysin (Enzyme)
Gene: npr
UniProt: P00800 (THER_BACTH)
Organism: Bacillus thermoproteolyticus
Activity: IC50 = 5.02
Drug: acetoxolone
Target: Liver carboxylesterase 1 (Enzyme)
Gene: CES1
UniProt: P23141 (EST1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.3
Assay: Inhibition of CE1 in human liver microsomes using 2-(2-Benzoyl-3-methoxyphenyl) benzothiazole as substrate preincubated for 10 mins followed by substrate addition measured after 30 mins by LC-UV analysis
Drug: acetoxolone
Target: Estradiol 17-beta-dehydrogenase 1 (Enzyme)
Gene: HSD17B1
UniProt: P14061 (DHB1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.73
Assay: Inhibition of human recombinant 17betaHSD1 expressed in HEK293 cells
Drug: acetoxolone
Target: Estradiol 17-beta-dehydrogenase 2 (Enzyme)
Gene: HSD17B2
UniProt: P37059 (DHB2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.42
Assay: Inhibition of human recombinant 17-beta-HSD2 expressed in HEK293 cells
Drug: acetoxolone
Target: Corticosteroid 11-beta-dehydrogenase isozyme 2 (Enzyme)
Gene: HSD11B2
UniProt: P80365 (DHI2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.7
Assay: Inhibition of human recombinant 11-beta-HSD2 expressed in HEK293 cells
Drug: acetoxolone
Target: Corticosteroid 11-beta-dehydrogenase isozyme 1 (Enzyme)
Gene: HSD11B1
UniProt: P28845 (DHI1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.1
Assay: Inhibition of human recombinant 11-beta-HSD1 expressed in HEK293 cells
Drug: acetoxolone
Target: Cocaine esterase (Enzyme)
Gene: CES2
UniProt: O00748 (EST2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.39
Assay: Inhibition of CE2 in human liver microsomes using fluorescein diacetate as substrate preincubated for 10 mins followed by substrate addition measured after 30 mins by LC-UV analysis
Drug: acetylcholine
Target: Muscarinic acetylcholine receptor M1 (GPCR)
Gene: CHRM1
UniProt: P11229 (ACM1_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 6.11
Assay: Activation of M1-ACh receptor-FLASH/CFP expressed in HEK293 cells assessed as FRET signal
Drug: acetylcholine
Target: Muscarinic acetylcholine receptor M2 (GPCR)
Gene: CHRM2
UniProt: P08172 (ACM2_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.5
Action type: AGONIST
Drug: acetylcholine
Target: Muscarinic acetylcholine receptor M3 (GPCR)
Gene: CHRM3
UniProt: P20309 (ACM3_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 6.66
Action type: AGONIST
Assay: Activation of M3-ACh receptor-FLASH/CFP expressed in HEK293 cells assessed as FRET signal
Drug: acetylcholine
Target: Muscarinic acetylcholine receptor M4 (GPCR)
Gene: CHRM4
UniProt: P08173 (ACM4_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.6
Action type: AGONIST
Drug: acetylcholine
Target: Muscarinic acetylcholine receptor M5 (GPCR)
Gene: CHRM5
UniProt: P08912 (ACM5_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 6.1
Assay: Activation of M5-ACh receptor-FLASH/CFP expressed in HEK293 cells assessed as FRET signal
Drug: acetylcholine
Target: Neuronal acetylcholine receptor subunit alpha-7 (Ion channel)
Gene: CHRNA7
UniProt: P36544 (ACHA7_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.1
Assay: Displacement of [3H]-MLA from human alpha7 nAChR expressed in human SH-SY5Y cells after 1.5 hrs by liquid scintillation counting
Drug: acetylcholine
Target: Acetylcholine-binding protein (Unclassified)
UniProt: P58154 (ACHP_LYMST)
Organism: Lymnaea stagnalis
Activity: Ki = 5.5
Assay: Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP
Drug: acetylcholine
Target: Acetylcholine receptor subunit delta (Ion channel)
Gene: chrnd
UniProt: P02718 (ACHD_TORCA)
Organism: Torpedo californica
Activity: Ki = 7.37
Assay: Binding affinity towards rat forebrain nicotinic acetylcholine receptor using [3H]EB as radioligand
Drug: acetylcholine
Target: Neuronal acetylcholine receptor subunit alpha-7 (Ion channel)
Gene: Chrna7
UniProt: Q05941 (ACHA7_RAT)
Organism: Rattus norvegicus
Activity: Ki = 5.45
Assay: Displacement of [3H]alpha-bungaro-toxine from nicotinic alpha-7 receptor in rat brain
Drug: acetylcholine
Target: Neuronal acetylcholine receptor; alpha2/beta2 (Ion channel)
Gene: Chrna2|Chrnb2
UniProt: P12389|P12390 (ACHA2_RAT|ACHB2_RAT)
Organism: Rattus norvegicus
Activity: Ki = 7.96
Assay: Binding affinity towards rat nicotinic acetylcholine receptor alpha2-beta2 expressed in HEK293 cells using [3H]EB as radioligand
Drug: acetylcholine
Target: Neuronal acetylcholine receptor; alpha3/beta2 (Ion channel)
Gene: Chrna3|Chrnb2
UniProt: P04757|P12390 (ACHA3_RAT|ACHB2_RAT)
Organism: Rattus norvegicus
Activity: Ki = 7.39
Assay: Binding affinity towards rat Nicotinic acetylcholine receptor alpha3-beta2 expressed in HEK293 cells using [3H]EB as radioligand
Drug: acetylcholine
Target: Neuronal acetylcholine receptor; alpha3/beta4 (Ion channel)
Gene: Chrna3|Chrnb4
UniProt: P04757|P12392 (ACHA3_RAT|ACHB4_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.21
Assay: Displacement of [3H]epibatidine from rat alpha3beta4 nAChR expressed in HEK292 cells after 3 hrs
Drug: acetylcholine
Target: Neuronal acetylcholine receptor; alpha4/beta2 (Ion channel)
Gene: Chrna4|Chrnb2
UniProt: P09483|P12390 (ACHA4_RAT|ACHB2_RAT)
Organism: Rattus norvegicus
Activity: Ki = 8.12
Assay: Displacement of [3H]-cytisine from Alpha4-beta2 Nicotinic acetylcholine receptor of rat brain homogenates
Drug: acetylcholine
Target: Neuronal acetylcholine receptor; alpha4/beta4 (Ion channel)
Gene: Chrna4|Chrnb4
UniProt: P09483|P12392 (ACHA4_RAT|ACHB4_RAT)
Organism: Rattus norvegicus
Activity: Ki = 7.24
Assay: Displacement of [3H]epibatidine from rat recombinant alpha4beta4 nAChR expressed in HEK293 cells after 4 hrs by scintillation counting analysis
Drug: acetylcholine
Target: Neuronal acetylcholine receptor; alpha4/beta2 (Ion channel)
Gene: CHRNB2|CHRNA4
UniProt: P17787|P43681 (ACHB2_HUMAN|ACHA4_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.8
Assay: Partial agonist activity at human 2:3 alpha4beta2 nAChR expressed in Xenopus laevis oocytes after 1 min by two electrode voltage clamp technique
Drug: acetylcholine
Target: Muscarinic acetylcholine receptor (GPCR)
Gene: Chrm1|Chrm3|Chrm4|Chrm5|Chrm2
UniProt: P08482|P08483|P08485|P08911|P10980 (ACM1_RAT|ACM3_RAT|ACM4_RAT|ACM5_RAT|ACM2_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 7.92
Assay: Compound was tested in vitro for its binding affinity to muscarinic acetylcholine receptor from rat cortical homogenates using [3H]OXO-M as radioligand
Drug: acetylcholine
Target: Nicotinic acetylcholine receptor alpha8 subunit (Ion channel)
UniProt: H6TY12 (H6TY12_PERAM)
Organism: Periplaneta americana
Activity: EC50 = 4.94
Assay: Agonist activity at Periplaneta americana (American cockroach) nAChR in terminal abdominal ganglion assessed as assessed as inward current by tight-seal whole cell patch clamp method
Drug: acetylcysteine
Target: Cytochrome c (Enzyme)
Gene: CYCS
UniProt: P99999 (CYC_HUMAN)
Organism: Homo sapiens
Drug: acetylcysteine
Target: Vascular endothelial growth factor A (Secreted)
Gene: VEGFA
UniProt: P15692 (VEGFA_HUMAN)
Organism: Homo sapiens
Drug: acetylcysteine
Target: Superoxide dismutase [Mn], mitochondrial (Enzyme)
Gene: SOD2
UniProt: P04179 (SODM_HUMAN)
Organism: Homo sapiens
Drug: acetylcysteine
Target: Glutathione synthetase (Enzyme)
Gene: GSS
UniProt: P48637 (GSHB_HUMAN)
Organism: Homo sapiens
Action type: MODULATOR
Drug: acetylcysteine
Target: Cystine/glutamate transporter (Transporter)
Gene: SLC7A11
UniProt: Q9UPY5 (XCT_HUMAN)
Organism: Homo sapiens
Action type: MODULATOR
Drug: acetyldigitoxin
Target: Sodium/potassium-transporting ATPase (Transporter)
Gene: ATP1A1|ATP1B1|ATP1A3|ATP1B2|ATP1A2|ATP1B3|FXYD2|ATP1A4
UniProt: P05023|P05026|P13637|P14415|P50993|P54709|P54710|Q13733 (AT1A1_HUMAN|AT1B1_HUMAN|AT1A3_HUMAN|AT1B2_HUMAN|AT1A2_HUMAN|AT1B3_HUMAN|ATNG_HUMAN|AT1A4_HUMAN)
Organism: Homo sapiens
Action type: INHIBITOR
Assay: Mechanism of Action; CHEMBL2095186; PROTEIN COMPLEX GROUP
Drug: acepromazine
Target: D(1A) dopamine receptor (GPCR)
Gene: DRD1
UniProt: P21728 (DRD1_HUMAN)
Organism: Homo sapiens
Action type: ANTAGONIST
Drug: acepromazine
Target: D(2) dopamine receptor (GPCR)
Gene: DRD2
UniProt: P14416 (DRD2_HUMAN)
Organism: Homo sapiens
Action type: ANTAGONIST
Drug: acepromazine
Target: Major prion protein (Surface antigen)
Gene: PRNP
UniProt: P04156 (PRIO_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.3
Assay: Half maximal inhibition of Prion protein PrPsc formation was assayed in ScN2a cells
Drug: acetylsalicylic acid
Target: Prostaglandin G/H synthase 2 (Enzyme)
Gene: PTGS2
UniProt: P35354 (PGH2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.12
Action type: INHIBITOR
Drug: acetylsalicylic acid
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: P23219 (PGH1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.77
Action type: INHIBITOR
Drug: acetylsalicylic acid
Target: Acidic phospholipase A2 3 (Enzyme)
UniProt: P60045 (PA2A3_NAJSG)
Organism: Naja sagittifera
Activity: Kd = 5.2
Drug: acetylsalicylic acid
Target: Gamma-glutamyltranspeptidase 1 (Enzyme)
Gene: GGT1
UniProt: P19440 (GGT1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.44
Assay: Inhibition of gamma-glutamyltranspeptidase by colorimetric assay
Drug: acetylsalicylic acid
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: P05979 (PGH1_SHEEP)
Organism: Ovis aries
Activity: IC50 = 6.52
Assay: In vitro inhibitory concentration against COX-1 enzyme
Drug: acetylsalicylic acid
Target: Prostaglandin G/H synthase 2 (Enzyme)
Gene: PTGS2
UniProt: P79208 (PGH2_SHEEP)
Organism: Ovis aries
Activity: IC50 = 5.62
Assay: In vitro inhibition of ovine prostaglandin G/H synthase 2
Drug: acetylsalicylic acid
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: O62664 (PGH1_BOVIN)
Organism: Bos taurus
Activity: IC50 = 6.46
Assay: Inhibition of bovine COX-1 by enzyme immuno assay
Drug: acetylsalicylic acid
Target: Acid-sensing ion channel 3 (Ion channel)
Gene: ASIC3
UniProt: Q9UHC3 (ASIC3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4
Action type: BLOCKER
Drug: acetylsalicylic acid
Target: Nicotinate phosphoribosyltransferase (Enzyme)
Gene: NAPRT
UniProt: Q6XQN6 (PNCB_HUMAN)
Organism: Homo sapiens
Activity: Ki = 9.3
Assay: Inhibition of NAPRT (unknown origin)
Drug: acipimox
Target: Hydroxycarboxylic acid receptor 2 (GPCR)
Gene: HCAR2
UniProt: Q8TDS4 (HCAR2_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.6
Action type: AGONIST
Drug: acitretin
Target: Retinoic acid receptor alpha (Nuclear hormone receptor)
Gene: RARA
UniProt: P10276 (RARA_HUMAN)
Organism: Homo sapiens
Action type: AGONIST
Assay: Mechanism of Action
Drug: acitretin
Target: Bile salt export pump (Transporter)
Gene: ABCB11
UniProt: O95342 (ABCBB_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.74
Drug: acitretin
Target: Retinoic acid receptor gamma (Nuclear hormone receptor)
Gene: RARG
UniProt: P13631 (RARG_HUMAN)
Organism: Homo sapiens
Action type: AGONIST
Assay: Mechanism of Action
Drug: acitretin
Target: Bile salt export pump (Transporter)
Gene: Abcb11
UniProt: O70127 (ABCBB_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 4.71
Drug: aclarubicin
Target: 5-hydroxytryptamine receptor 2B (GPCR)
Gene: HTR2B
UniProt: P41595 (5HT2B_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.152
Assay: DRUGMATRIX: Serotonin (5-Hydroxytryptamine) 5-HT2B radioligand binding (ligand: [3H] Lysergic acid diethylamide)
Drug: aclarubicin
Target: 72 kDa type IV collagenase (Enzyme)
Gene: MMP2
UniProt: P08253 (MMP2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5
Assay: Concentration inhibiting Clostridium histolyticum collagenase.
Drug: aclarubicin
Target: DNA topoisomerase 1 (Enzyme)
Gene: TOP1
UniProt: P11387 (TOP1_HUMAN)
Organism: Homo sapiens
Action type: INHIBITOR
Assay: Topoisomerase inhibitor
Drug: aclarubicin
Target: DNA topoisomerase II (Enzyme)
Gene: TOP2A|TOP2B
UniProt: P11388|Q02880 (TOP2A_HUMAN|TOP2B_HUMAN)
Organism: Homo sapiens
Action type: INHIBITOR
Assay: Topoisomerase inhibitor
Drug: aclatonium
Target: Muscarinic acetylcholine receptor (GPCR)
Gene: CHRM2|CHRM4|CHRM5|CHRM1|CHRM3
UniProt: P08172|P08173|P08912|P11229|P20309 (ACM2_HUMAN|ACM4_HUMAN|ACM5_HUMAN|ACM1_HUMAN|ACM3_HUMAN)
Organism: Homo sapiens
Action type: AGONIST
Assay: Mechanism of Action
Drug: acrivastine
Target: Multidrug resistance protein 1 (Transporter)
Gene: ABCB1
UniProt: P08183 (MDR1_HUMAN)
Organism: Homo sapiens
Drug: acrivastine
Target: Histamine H1 receptor (GPCR)
Gene: HRH1
UniProt: P35367 (HRH1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.16
Action type: ANTAGONIST
Drug: acrivastine
Target: Histamine H1 receptor (GPCR)
Gene: HRH1
UniProt: P31389 (HRH1_CAVPO)
Organism: Cavia porcellus
Activity: IC50 = 5.21
Assay: Inhibition of H1 receptor in Cavia porcellus Hartley (guinea pig) ileum assessed as inhibition of histamine-induced spasms incubated 2 min prior histamine-challenge
Drug: acyclovir
Target: Purine nucleoside phosphorylase (Enzyme)
Gene: PNP
UniProt: P00491 (PNPH_HUMAN)
Organism: Homo sapiens
Activity: Ki = 4.04
Assay: Inhibition of human PNP
Drug: acyclovir
Target: Thymidine kinase (Kinase)
UniProt: P09250 (KITH_VZVD)
Organism: Varicella-zoster virus (strain Dumas)
Drug: acyclovir
Target: Purine nucleoside phosphorylase (Enzyme)
Gene: punA
UniProt: P9WP01 (PUNA_MYCTU)
Organism: Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Activity: Kd = 4.9
Assay: Binding affinity to Mycobacterium tuberculosis purine nucleoside phosphorylase by spectrophotometric analysis
Drug: acyclovir
Target: DNA polymerase catalytic subunit (Enzyme)
UniProt: P04293 (DPOL_HHV11)
Organism: Human herpesvirus 1 (strain 17)
Action type: INHIBITOR
Drug: acyclovir
Target: DNA polymerase catalytic subunit (Enzyme)
UniProt: P09252 (DPOL_VZVD)
Organism: Varicella-zoster virus (strain Dumas)
Action type: INHIBITOR
Drug: acyclovir
Target: Thymidine kinase (Kinase)
Gene: TK
UniProt: Q9QNF7 (KITH_HHV1)
Organism: Human herpesvirus 1
Action type: INHIBITOR