AIM-Harvard/TrialPanorama-filtered huggingface dataset:
Drug: maprotiline
Target: Muscarinic acetylcholine receptor M1 (GPCR)
Gene: CHRM1
UniProt: P11229 (ACM1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.845
Assay: DRUGMATRIX: Muscarinic M1 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: maprotiline
Target: Muscarinic acetylcholine receptor M2 (GPCR)
Gene: CHRM2
UniProt: P08172 (ACM2_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.164
Assay: DRUGMATRIX: Muscarinic M2 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: maprotiline
Target: Muscarinic acetylcholine receptor M3 (GPCR)
Gene: CHRM3
UniProt: P20309 (ACM3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 7
Assay: DRUGMATRIX: Muscarinic M3 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: maprotiline
Target: Muscarinic acetylcholine receptor M4 (GPCR)
Gene: CHRM4
UniProt: P08173 (ACM4_HUMAN)
Organism: Homo sapiens
Activity: Ki = 7.237
Assay: DRUGMATRIX: Muscarinic M4 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: maprotiline
Target: Muscarinic acetylcholine receptor M5 (GPCR)
Gene: CHRM5
UniProt: P08912 (ACM5_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.939
Assay: DRUGMATRIX: Muscarinic M5 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: maprotiline
Target: Aldehyde oxidase (Enzyme)
Gene: AOX1
UniProt: Q06278 (AOXA_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.854
Drug: maprotiline
Target: Alpha-2C adrenergic receptor (GPCR)
Gene: ADRA2C
UniProt: P18825 (ADA2C_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.355
Assay: DRUGMATRIX: Adrenergic Alpha-2C radioligand binding (ligand: [3H] MK-912)
Drug: maprotiline
Target: Sodium-dependent dopamine transporter (Transporter)
Gene: SLC6A3
UniProt: Q01959 (SC6A3_HUMAN)
Organism: Homo sapiens
Activity: Kd = 6
Drug: maprotiline
Target: Alpha-1D adrenergic receptor (GPCR)
Gene: ADRA1D
UniProt: P25100 (ADA1D_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.71
Assay: DRUGMATRIX: Alpha-1D adrenergic receptor radioligand binding (ligand: prazosin)
Drug: maprotiline
Target: ATP-binding cassette sub-family G member 2 (Transporter)
Gene: ABCG2
UniProt: Q9UNQ0 (ABCG2_HUMAN)
Organism: Homo sapiens
Drug: maprotiline
Target: Alpha-1B adrenergic receptor (GPCR)
Gene: Adra1b
UniProt: P15823 (ADA1B_RAT)
Organism: Rattus norvegicus
Activity: Ki = 7.046
Assay: DRUGMATRIX: Alpha-1B adrenergic receptor radioligand binding (ligand: prazosin)
Drug: maprotiline
Target: Alpha-1A adrenergic receptor (GPCR)
Gene: Adra1a
UniProt: P43140 (ADA1A_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 6.25
Drug: maprotiline
Target: G protein-activated inward rectifier potassium channel 2 (Ion channel)
Gene: Kcnj6
UniProt: P48542 (KCNJ6_MOUSE)
Organism: Mus musculus
Activity: IC50 = 4
Action type: BLOCKER
Drug: maprotiline
Target: Transient receptor potential cation channel subfamily M member 3 (Ion channel)
Gene: TRPM3
UniProt: Q9HCF6 (TRPM3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.8
Action type: BLOCKER
Drug: maraviroc
Target: C-C chemokine receptor type 5 (GPCR)
Gene: CCR5
UniProt: P51681 (CCR5_HUMAN)
Organism: Homo sapiens
Activity: Kd = 7.6
Action type: ANTAGONIST
Assay: Binding affinity to CCR5
Drug: maraviroc
Target: C-C chemokine receptor type 5 (GPCR)
Gene: Ccr5
UniProt: P51682 (CCR5_MOUSE)
Organism: Mus musculus
Activity: IC50 = 8.28
Assay: Displacement of [125I]-RANTES from CCR5 in mouse NIH/3T3 cells after 1 hr
Drug: maraviroc
Target: Multidrug and toxin extrusion protein 1 (Transporter)
Gene: SLC47A1
UniProt: Q96FL8 (S47A1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.76
Assay: Inhibition of human MATE1-mediated ASP+ uptake expressed in HEK293 cells after 1.5 mins by fluorescence assay
Drug: maraviroc
Target: C-C chemokine receptor type 5 (GPCR)
Gene: CCR5
UniProt: P61813 (CCR5_MACMU)
Organism: Macaca mulatta
Activity: Ki = 9.62
Assay: Displacement of [125I]-MIP-1alpha from CCR5 in rhesus monkey Chem-1 cell membranes after 120 mins by liquid scintillation counting analysis
Drug: masoprocol
Target: Transthyretin (Secreted)
Gene: TTR
UniProt: P02766 (TTHY_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.14
Drug: masoprocol
Target: Estrogen receptor (Nuclear hormone receptor)
Gene: ESR1
UniProt: P03372 (ESR1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.65
Assay: PUBCHEM_BIOASSAY: Estrogen Receptor-alpha Coactivator Binding Inhibitors Dose Response Confirmation. (Class of assay: confirmatory) [Related pubchem assays: 629 (Primary screen preceding this dose response confirmation assay.)]
Drug: masoprocol
Target: Androgen receptor (Nuclear hormone receptor)
Gene: AR
UniProt: P10275 (ANDR_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.41
Assay: Transcriptional activity at human androgen receptor BF3 site stably transfected in eGFP-expressing human LNCAP cells after 5 days by fluorometric analysis
Drug: masoprocol
Target: Aromatase (Enzyme)
Gene: CYP19A1
UniProt: P11511 (CP19A_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.96
Assay: Inhibition of human placental microsome CYP19
Drug: masoprocol
Target: Arachidonate 5-lipoxygenase (Enzyme)
Gene: ALOX5
UniProt: P09917 (LOX5_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.6
Assay: Inhibition of recombinant human 5-LOX in human PBML assessed as inhibition of A23187-induced LTB4 production preincubated for 15 mins measured after 15 mins by enzyme immunoassay
Drug: masoprocol
Target: Insulin-like growth factor 1 receptor (Kinase)
Gene: IGF1R
UniProt: P08069 (IGF1R_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.05
Assay: Inhibition of IGF1R
Drug: masoprocol
Target: Arachidonate 15-lipoxygenase (Enzyme)
Gene: ALOX15
UniProt: P16050 (LOX15_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.96
Assay: Inhibitory activity against human reticulocyte 15-lipoxygenase (15-HLO)
Drug: masoprocol
Target: Estradiol 17-beta-dehydrogenase 1 (Enzyme)
Gene: HSD17B1
UniProt: P14061 (DHB1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.26
Assay: Inhibition of human 17beta-HSD1 expressed in HEK293 cell lysates incubated for 10 mins using [2,4,6,7-3H]-estrone and NADPH by scintillation counting method
Drug: masoprocol
Target: Estradiol 17-beta-dehydrogenase 2 (Enzyme)
Gene: HSD17B2
UniProt: P37059 (DHB2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.42
Assay: Inhibition of human 17beta-HSD2 expressed in HEK293 cell lysates incubated for 10 mins using [2,4,6,7-3H]-estradiol and NAD+ by scintillation counting method
Drug: masoprocol
Target: Arachidonate 12-lipoxygenase, 12S-type (Enzyme)
Gene: ALOX12
UniProt: P18054 (LOX12_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.96
Assay: Inhibition of human platelet-type 12-lipoxygenase
Drug: masoprocol
Target: Leukotriene B4 receptor 1 (GPCR)
Gene: LTB4R
UniProt: Q15722 (LT4R1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.07
Assay: The compound was tested for its inhibitory activity against LTB4 in human PMN
Drug: masoprocol
Target: Transient receptor potential cation channel subfamily A member 1 (Ion channel)
Gene: TRPA1
UniProt: O75762 (TRPA1_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.31
Assay: Agonist activity at human TRPA1 expressed in HEK293 cells assessed as increase in calcium influx by Calcium-5 dye based fluorescence assay
Drug: masoprocol
Target: Arachidonate 15-lipoxygenase (Enzyme)
Gene: ALOX15
UniProt: P12530 (LOX15_RABIT)
Organism: Oryctolagus cuniculus
Activity: IC50 = 6.96
Assay: Inhibitory concentration against isolated rabbit reticulocyte 15-lipoxygenase measured in the presence of linoleic acid
Drug: masoprocol
Target: Arachidonate 5-lipoxygenase (Enzyme)
Gene: Alox5
UniProt: P12527 (LOX5_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 8
Assay: Inhibition of 5-lipoxygenase from rat basophilic leukemia(RBL-1) cells
Drug: masoprocol
Target: Seed linoleate 13S-lipoxygenase-1 (Enzyme)
Gene: LOX1.1
UniProt: P08170 (LOX1_SOYBN)
Organism: Glycine max
Activity: IC50 = 6.74
Assay: Inhibitory activity against soybean 1-lipoxygenase (SLO)
Drug: masoprocol
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: O62664 (PGH1_BOVIN)
Organism: Bos taurus
Activity: IC50 = 4.3
Assay: Inhibition of COX1 in bovine platelets assessed as formation of 12-hydroxyheptadecatrienoic acid by HPLC
Drug: masoprocol
Target: Zinc finger protein mex-5 (Cytosolic other)
Gene: mex-5
UniProt: Q9XUB2 (MEX5_CAEEL)
Organism: Caenorhabditis elegans
Activity: EC50 = 5.06
Assay: Active
Drug: masoprocol
Target: 5-lipoxygenase (Enzyme)
UniProt: Q9BEG3 (Q9BEG3_BOVIN)
Organism: Bos taurus
Activity: IC50 = 6.4
Assay: Inhibitory activity against 5-lipoxygenase (inhibition of 5-HETE and LTB4 biosynthesis) in bovine polymorphonuclear leukocytes (PMNL).
Drug: masoprocol
Target: Arachidonate 5-lipoxygenase (Enzyme)
Gene: Alox5
UniProt: P48999 (LOX5_MOUSE)
Organism: Mus musculus
Activity: IC50 = 6.4
Assay: Inhibition of 5-LOX in calcium ionophore A23187-stimulated NMRI mouse macrophage assessed as inhibition of LTC4 production preincubated for 60 mins before stimulation measured after 2 hrs by ELISA
Drug: masoprocol
Target: Cyclooxygenase (Enzyme)
Gene: PTGS1|PTGS2
UniProt: O62664|O62698 (PGH1_BOVIN|PGH2_BOVIN)
Organism: Bos taurus
Activity: IC50 = 4.85
Assay: In vitro inhibition of Prostaglandin G/H synthase in BSV cell line.
Drug: masoprocol
Target: Arachidonate 15-lipoxygenase, type II (Enzyme)
Gene: ALOX15B
UniProt: O15296 (LX15B_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.96
Assay: Inhibition of 15-hLO2
Drug: masoprocol
Target: Lipoxygenase (Unclassified)
UniProt: Q39829 (Q39829_SOYBN)
Organism: Glycine max
Activity: IC50 = 4.29
Drug: masoprocol
Target: Cytoplasmic zinc-finger protein (Unclassified)
Gene: pos-1
UniProt: G5EF15 (G5EF15_CAEEL)
Organism: Caenorhabditis elegans
Activity: EC50 = 4.58
Assay: Active
Drug: masoprocol
Target: Fatty acid hydroperoxide lyase, chloroplastic (Enzyme)
Gene: HPL
UniProt: K4CF70 (HPL_SOLLC)
Organism: Solanum lycopersicum
Activity: IC50 = 4.3
Assay: Inhibition of recombinant Solanum lycopersicum (tomato) fatty acid 13-hydroperoxide lyase using (13S)-HPOT substrate by spectrophotometry
Drug: maxacalcitol
Target: Vitamin D3 receptor (Nuclear hormone receptor)
Gene: VDR
UniProt: P11473 (VDR_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 9.07
Assay: Activation of VDR in human Jurkat cells expressing lentiviral VDRE-luciferase vector assessed as VDRE-mediated transcriptional activity measured after 24 hrs by luciferase transcriptional reporter assay
Drug: maxacalcitol
Target: Vitamin D3 receptor (Transcription factor)
Gene: Vdr
UniProt: P13053 (VDR_RAT)
Organism: Rattus norvegicus
Activity: EC50 = 8.21
Action type: AGONIST
Drug: mazindol
Target: Sigma non-opioid intracellular receptor 1 (Membrane receptor)
Gene: SIGMAR1
UniProt: Q99720 (SGMR1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.63
Assay: The compound was tested for affinity towards sigma-3 receptor
Drug: mazindol
Target: Sodium-dependent serotonin transporter (Transporter)
Gene: SLC6A4
UniProt: P31645 (SC6A4_HUMAN)
Organism: Homo sapiens
Activity: Ki = 7.3
Action type: INHIBITOR
Assay: Displacement of [125I]- RTI-55 from Serotonin transporter expressed in HEK cells
Drug: mazindol
Target: Sodium-dependent noradrenaline transporter (Transporter)
Gene: SLC6A2
UniProt: P23975 (SC6A2_HUMAN)
Organism: Homo sapiens
Activity: Kd = 9.3
Action type: INHIBITOR
Assay: GRAC: human NET probe
Drug: mazindol
Target: Histamine H1 receptor (GPCR)
Gene: HRH1
UniProt: P35367 (HRH1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.222
Drug: mazindol
Target: Sodium-dependent dopamine transporter (Transporter)
Gene: SLC6A3
UniProt: Q01959 (SC6A3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 8
Action type: INHIBITOR
Assay: GRAC: human DAT selective inhibitor
Drug: mazindol
Target: Sodium-dependent serotonin transporter (Transporter)
Gene: Slc6a4
UniProt: P31652 (SC6A4_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.61
Assay: Binding affinity to the serotonin transporter (SERT) measured by displacement of [3H]paroxetine in male wistar rats
Drug: mazindol
Target: Sodium-dependent dopamine transporter (Transporter)
Gene: Slc6a3
UniProt: P23977 (SC6A3_RAT)
Organism: Rattus norvegicus
Activity: Kd = 8.06
Assay: Binding affinity to a single, sodium-dependent site on the Dopamine transporter in rat striatal membranes
Drug: mazindol
Target: Transporter (Transporter)
Gene: Slc6a2
UniProt: Q9WTR4 (Q9WTR4_RAT)
Organism: Rattus norvegicus
Activity: Ki = 9.1
Assay: Binding affinity against norepinephrine transporter (NET) by displacement of [3H]nisoxetine in male wistar rats
Drug: mazindol
Target: Sodium-dependent dopamine transporter (Transporter)
Gene: Slc6a3
UniProt: Q61327 (SC6A3_MOUSE)
Organism: Mus musculus
Activity: IC50 = 7.89
Assay: Inhibition of mouse DAT expressed in HEK293 cells assessed as reduction in [3H]-DA uptake
Drug: mebendazole
Target: Tyrosine-protein kinase ABL1 (Kinase)
Gene: ABL1
UniProt: P00519 (ABL1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.34
Assay: Inhibition of human ABL by radiometric assay
Drug: mebendazole
Target: Vascular endothelial growth factor receptor 2 (Kinase)
Gene: KDR
UniProt: P35968 (VGFR2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.44
Assay: Inhibition of VEGFR2 after 60 mins by electrophoretic mobility shift assay
Drug: mebendazole
Target: Calmodulin-domain protein kinase 1 (Kinase)
Gene: CDPK1
UniProt: Q9BJF5 (Q9BJF5_TOXGO)
Organism: Toxoplasma gondii
Activity: IC50 = 6.17
Assay: Inhibition of Toxoplasma gondii CDPK1
Drug: mebendazole
Target: Tubulin (Structural)
UniProt: C4PKY4|C4PKZ2|C4PKZ6 (C4PKY4_ECHGR|C4PKZ2_ECHGR|C4PKZ6_ECHGR)
Organism: Echinococcus granulosus
Action type: INHIBITOR
Assay: Mechanism of Action; CHEMBL2364704; PROTEIN COMPLEX GROUP
Drug: mebendazole
Target: Tubulin (Structural)
UniProt: F1L005|F1L4P8|F1L5G6|F1L7U3|F1L7Y0|F1L8A5|F1LCS0 (F1L005_ASCSU|F1L4P8_ASCSU|F1L5G6_ASCSU|F1L7U3_ASCSU|F1L7Y0_ASCSU|F1L8A5_ASCSU|F1LCS0_ASCSU)
Organism: Ascaris suum
Action type: INHIBITOR
Assay: Mechanism of Action; CHEMBL2364705; PROTEIN COMPLEX GROUP
Drug: mebhydrolin
Target: Histamine H1 receptor (GPCR)
Gene: HRH1
UniProt: P35367 (HRH1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 7.119
Action type: ANTAGONIST
Drug: mebhydrolin
Target: Histamine H4 receptor (GPCR)
Gene: HRH4
UniProt: Q9H3N8 (HRH4_HUMAN)
Organism: Homo sapiens
Drug: mebhydrolin
Target: Muscarinic acetylcholine receptor M1 (GPCR)
Gene: CHRM1
UniProt: P11229 (ACM1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.745
Drug: mebhydrolin
Target: 5-hydroxytryptamine receptor 5A (GPCR)
Gene: HTR5A
UniProt: P47898 (5HT5A_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.921
Drug: mecamylamine
Target: Neuronal acetylcholine receptor subunit alpha-7 (Ion channel)
Gene: CHRNA7
UniProt: P36544 (ACHA7_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.161
Drug: mecamylamine
Target: Acetylcholine receptor subunit alpha (Ion channel)
Gene: CHRNA1
UniProt: P02710 (ACHA_TORCA)
Organism: Torpedo californica
Activity: IC50 = 6.22
Drug: mecamylamine
Target: Neuronal acetylcholine receptor; alpha2/beta4 (Ion channel)
Gene: CHRNB4|CHRNA2
UniProt: P30926|Q15822 (ACHB4_HUMAN|ACHA2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.51
Assay: Inhibitory concentration against Nicotinic acetylcholine receptor alpha2-beta4
Drug: mecamylamine
Target: Neuronal acetylcholine receptor; alpha4/beta2 (Ion channel)
Gene: CHRNB2|CHRNA4
UniProt: P17787|P43681 (ACHB2_HUMAN|ACHA4_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.602
Drug: mecamylamine
Target: Neuronal acetylcholine receptor; alpha3/beta4 (Ion channel)
Gene: CHRNB4|CHRNA3
UniProt: P30926|P32297 (ACHB4_HUMAN|ACHA3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.222
Action type: NEGATIVE ALLOSTERIC MODULATOR
Drug: mecamylamine
Target: Neuronal acetylcholine receptor; alpha3/beta2 (Ion channel)
Gene: CHRNB2|CHRNA3
UniProt: P17787|P32297 (ACHB2_HUMAN|ACHA3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.55
Assay: Inhibitory concentration against Nicotinic acetylcholine receptor alpha3-beta2
Drug: mecamylamine
Target: Neuronal acetylcholine receptor; alpha4/beta4 (Ion channel)
Gene: CHRNB4|CHRNA4
UniProt: P30926|P43681 (ACHB4_HUMAN|ACHA4_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.48
Action type: BLOCKER
Drug: mecamylamine
Target: Neuronal acetylcholine receptor; alpha3/alpha6/beta2/beta3 (Ion channel)
Gene: CHRNB2|CHRNA3|CHRNB3|CHRNA6
UniProt: P17787|P32297|Q05901|Q15825 (ACHB2_HUMAN|ACHA3_HUMAN|ACHB3_HUMAN|ACHA6_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.96
Assay: GRAC: human AChR-alpha6-alpha3-beta2-beta3 [chimera] commonly used antagonist
Drug: mecamylamine
Target: Acetylcholine receptor subunit alpha (Ion channel)
Gene: CHRNA1
UniProt: P02708 (ACHA_HUMAN)
Organism: Homo sapiens
Activity: IC50 ~ 5.82
Action type: BLOCKER
Drug: mecamylamine
Target: Neuronal acetylcholine receptor subunit alpha-3 (Ion channel)
Gene: CHRNA3
UniProt: P32297 (ACHA3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.41
Action type: BLOCKER
Drug: mecamylamine
Target: Neuronal acetylcholine receptor subunit alpha-4 (Ion channel)
Gene: CHRNA4
UniProt: P43681 (ACHA4_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.48
Action type: BLOCKER
Drug: mecamylamine
Target: Neuronal acetylcholine receptor subunit alpha-6 (Ion channel)
Gene: CHRNA6
UniProt: Q15825 (ACHA6_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.96
Action type: BLOCKER
Drug: mecillinam
Target: Penicillin-binding protein 2 (Enzyme)
Gene: mrdA
UniProt: P0AD65 (PBP2_ECOLI)
Organism: Escherichia coli (strain K12)
Activity: IC50 = 7.035
Action type: INHIBITOR
Drug: meclozine
Target: Nuclear receptor subfamily 1 group I member 3 (Nuclear hormone receptor)
Gene: NR1I3
UniProt: Q14994 (NR1I3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.16
Action type: ANTAGONIST
Drug: meclozine
Target: Histamine H1 receptor (GPCR)
Gene: HRH1
UniProt: P35367 (HRH1_HUMAN)
Organism: Homo sapiens
Action type: ANTAGONIST
Assay: Mechanism of Action; CHEMBL231; SINGLE PROTEIN
Drug: meclozine
Target: Constitutive androstane receptor (Nuclear hormone receptor)
Gene: Nr1i3
UniProt: O35627 (NR1I3_MOUSE)
Organism: Mus musculus
Activity: EC50 = 7.6
Action type: AGONIST
Drug: meclozine
Target: Serine protease hepsin (Enzyme)
Gene: HPN
UniProt: P05981 (HEPS_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.7
Assay: High-Throughput Screening Assay: To identify novel inhibitors of hepsin, the Chembridge DIVERSet 10,000 compound high-diversity library was screened using an assay based on the cleavage of the chromogenic peptide. In addition, the NINDS II library of 1040 compounds (MicroSource Discovery) was screened to identify hepsin inhibitors among established drugs and known bioactive molecules. Screens were performed in a 96-well format at a final compound concentration of 2 uM. To minimize false positives, positions 1 and 12 of each row contained DMSO/buffer controls. As a measure of reproducibility, the Z' score for this assay was 0.78 (Zhang et al., 1999 J Biomol Screen 4:67).
Drug: meclofenamic acid
Target: Prostaglandin G/H synthase 2 (Enzyme)
Gene: PTGS2
UniProt: P35354 (PGH2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.7
Action type: INHIBITOR
Drug: meclofenamic acid
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: P23219 (PGH1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.66
Action type: INHIBITOR
Drug: meclofenamic acid
Target: Transthyretin (Secreted)
Gene: TTR
UniProt: P02766 (TTHY_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.3
Drug: meclofenamic acid
Target: Androgen receptor (Nuclear hormone receptor)
Gene: AR
UniProt: P10275 (ANDR_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.19
Drug: meclofenamic acid
Target: Aldo-keto reductase family 1 member C1 (Enzyme)
Gene: AKR1C1
UniProt: Q04828 (AK1C1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.5
Assay: Inhibition of human recombinant N-terminal His6-tagged AKR1C1 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-aza-benzo[de]anthracen-10-one as substrate after 1 hr by fluorimetric analysis
Drug: meclofenamic acid
Target: Aldo-keto reductase family 1 member C2 (Enzyme)
Gene: AKR1C2
UniProt: P52895 (AK1C2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.06
Assay: Inhibition of human recombinant N-terminal His6-tagged AKR1C2 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-aza-benzo[de]anthracen-10-one as substrate after 1 hr by fluorimetric analysis
Drug: meclofenamic acid
Target: Aldo-keto reductase family 1 member C3 (Enzyme)
Gene: AKR1C3
UniProt: P42330 (AK1C3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.27
Assay: Inhibition of human recombinant N-terminal His6-tagged AKR1C3 expressed in Escherichia coli BL21(DE3) cells using 8-Acetyl-2,3,5,6-tetrahydro-1H,4H-11-oxa-3a-aza-benzo[de]anthracen-10-one as substrate after 1 hr by fluorimetric analysis
Drug: meclofenamic acid
Target: Arachidonate 5-lipoxygenase (Enzyme)
Gene: ALOX5
UniProt: P09917 (LOX5_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.33
Action type: INHIBITOR
Drug: meclofenamic acid
Target: Fatty acid-binding protein, intestinal (Cytosolic other)
Gene: FABP2
UniProt: P12104 (FABPI_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.05
Assay: Displacement of 1-anilinonaphthalene-8-sulphonic acid from I-FABP
Drug: meclofenamic acid
Target: Fatty acid-binding protein, liver (Unclassified)
Gene: Fabp1
UniProt: P02692 (FABPL_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.59
Assay: Displacement of 1-anilinonaphthalene-8-sulphonic acid from rat recombinant L-FABP low binding affinity site expressed in Escherichia coli BL21 by competitive fluorescence displacement assay
Drug: meclofenamic acid
Target: Mitogen-activated protein kinase 1 (Kinase)
Gene: MAPK1
UniProt: P28482 (MK01_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.503
Assay: DRUGMATRIX: Protein Serine/Threonine Kinase, ERK2 enzyme inhibition (substrate: Myelin Basic Protein)
Drug: meclofenamic acid
Target: Prostaglandin G/H synthase 2 (Enzyme)
Gene: Ptgs2
UniProt: Q05769 (PGH2_MOUSE)
Organism: Mus musculus
Activity: IC50 = 6.7
Assay: Inhibition of the murine wild type Prostaglandin G/H synthase 2
Drug: meclofenamic acid
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: P05979 (PGH1_SHEEP)
Organism: Ovis aries
Activity: IC50 = 7.3
Assay: Inhibition of the ovine Prostaglandin G/H synthase 1 was determined by thin-layer chromatography assay
Drug: meclofenamic acid
Target: Arachidonate 5-lipoxygenase (Enzyme)
Gene: Alox5
UniProt: P12527 (LOX5_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 4.62
Assay: Compound was evaluated for its inhibitory activity against 5-LO (5-lipoxygenase)
Drug: meclofenamic acid
Target: Cyclooxygenase (Enzyme)
Gene: Ptgs2|Ptgs1
UniProt: P35355|Q63921 (PGH2_RAT|PGH1_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 7
Assay: Compound was evaluated for its inhibitory activity against CO(cyclooxygenase)
Drug: medazepam
Target: GABA-A receptor; anion channel (Ion channel)
Gene: Gabrp|Gabrb1|Gabrd|Gabrg2|Gabra5|Gabra3|Gabrg1|Gabra2|Gabra4|Gabrg3|Gabra6|Gabra1|Gabrb3|Gabrb2|Gabrq|Gabre
UniProt: O09028|P15431|P18506|P18508|P19969|P20236|P23574|P23576|P28471|P28473|P30191|P62813|P63079|P63138|Q91ZM7|Q9ES14 (GBRP_RAT|GBRB1_RAT|GBRD_RAT|GBRG2_RAT|GBRA5_RAT|GBRA3_RAT|GBRG1_RAT|GBRA2_RAT|GBRA4_RAT|GBRG3_RAT|GBRA6_RAT|GBRA1_RAT|GBRB3_RAT|GBRB2_RAT|Q91ZM7_RAT|GBRE_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.28
Assay: In vitro binding affinity against benzodiazepine receptor using [3H]diazepam as radioligand
Drug: medetomidine
Target: Adrenergic receptor alpha-2 (GPCR)
Gene: Adra2b|Adra2c|Adra2a
UniProt: P19328|P22086|P22909 (ADA2B_RAT|ADA2C_RAT|ADA2A_RAT)
Organism: Rattus norvegicus
Activity: Ki = 7.72
Assay: Tested for its binding affinity against alpha-2 receptor in rat brain membrane
Drug: medetomidine
Target: Adrenergic receptor alpha-1 (GPCR)
Gene: Adra1b|Adra1d|Adra1a
UniProt: P15823|P23944|P43140 (ADA1B_RAT|ADA1D_RAT|ADA1A_RAT)
Organism: Rattus norvegicus
Activity: Ki = 5.96
Assay: Alpha-1 adrenergic receptor binding affinity in rat brain membranes
Drug: medetomidine
Target: Adrenergic receptor alpha-2 (GPCR)
Gene: ADRA2A|ADRA2B|ADRA2C
UniProt: P08913|P18089|P18825 (ADA2A_HUMAN|ADA2B_HUMAN|ADA2C_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 8.52
Assay: Tested for its inhibitory activity against alpha-2 adrenoceptor in guinea pig ileum