AIM-Harvard/TrialPanorama-filtered huggingface dataset:
Drug: iloperidone
Target: 5-hydroxytryptamine receptor 2A (GPCR)
Gene: HTR2A
UniProt: Q75Z89 (5HT2A_BOVIN)
Organism: Bos taurus
Activity: IC50 = 8.05
Assay: Binding affinity against 5-hydroxytryptamine 2 receptor was determined using [ [3H]spiperone radioligand
Drug: iloperidone
Target: 5-hydroxytryptamine receptor 6 (GPCR)
Gene: Htr6
UniProt: P31388 (5HT6R_RAT)
Organism: Rattus norvegicus
Activity: Ki = 7.4
Action type: ANTAGONIST
Drug: iloperidone
Target: Serotonin 2 (5-HT2) receptor (GPCR)
Gene: Htr2c|Htr2a|Htr2b
UniProt: P08909|P14842|P30994 (5HT2C_RAT|5HT2A_RAT|5HT2B_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 8.05
Assay: Affinity for 5-hydroxytryptamine 2 receptor binding sites by its ability to displace [3H]spiperone from rat frontal cortex.
Drug: isoconazole
Target: Steroid 17-alpha-hydroxylase/17,20 lyase (Enzyme)
Gene: CYP17A1
UniProt: P05093 (CP17A_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.21
Assay: In vitro inhibition of human Cytochrome P450 17A1 activity
Drug: isoconazole
Target: Indoleamine 2,3-dioxygenase 1 (Enzyme)
Gene: IDO1
UniProt: P14902 (I23O1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.64
Drug: ivabradine
Target: Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 4 (Ion channel)
Gene: HCN4
UniProt: Q9Y3Q4 (HCN4_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.37
Assay: Blockade of human HCN4 expressed in HEK293 cells at -120 f-current amplitude by patch-clamp electrophysiological assay
Drug: ivabradine
Target: Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 1 (Ion channel)
Gene: Hcn1
UniProt: O88704 (HCN1_MOUSE)
Organism: Mus musculus
Activity: EC50 = 5.35
Assay: Blockade of mouse HCN1 expressed in HEK293 cells at -120 f-current amplitude by patch-clamp electrophysiological assay
Drug: ivabradine
Target: Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 (Ion channel)
Gene: Hcn2
UniProt: O88703 (HCN2_MOUSE)
Organism: Mus musculus
Activity: EC50 = 5.34
Assay: Blockade of mouse HCN2 expressed in HEK293 cells at -120 f-current amplitude by patch-clamp electrophysiological assay
Drug: ivabradine
Target: Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 1 (Ion channel)
Gene: HCN1
UniProt: O60741 (HCN1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.7
Action type: BLOCKER
Drug: ivabradine
Target: Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 2 (Ion channel)
Gene: HCN2
UniProt: Q9UL51 (HCN2_HUMAN)
Organism: Homo sapiens
Action type: BLOCKER
Drug: ivabradine
Target: Potassium/sodium hyperpolarization-activated cyclic nucleotide-gated channel 3 (Ion channel)
Gene: HCN3
UniProt: Q9P1Z3 (HCN3_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.7
Action type: BLOCKER
Drug: khellin
Target: Cytochrome P450 1A1 (Enzyme)
Gene: CYP1A1
UniProt: P04798 (CP1A1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.42
Assay: Inhibition of human recombinant CYP1A1 expressed in HEK293 cells using 7-ethoxyresorufin substrate preincubated for 30 mins followed by substrate addition and measured after 60 mins by fluorescence assay relative to control
Drug: lenalidomide
Target: Tumor necrosis factor (Cytokine)
Gene: TNF
UniProt: P01375 (TNFA_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.886
Drug: lenalidomide
Target: Cereblon isoform 4 (Unclassified)
UniProt: A4TVL0 (A4TVL0_9PROT)
Organism: Magnetospirillum gryphiswaldense
Activity: Ki = 5.51
Assay: Inhibition of MANT-uracil binding to wild-type Magnetospirillum gryphiswaldense CRBN isoform 4 by FRET assay
Drug: lenalidomide
Target: Protein cereblon (Cytosolic other)
Gene: CRBN
UniProt: Q96SW2 (CRBN_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 6.527
Action type: MODULATOR
Assay: competitive titration of thalidomide with human DDB1-human CRBN (50 nM) and Cy5-thalidomide (20 nM)
Drug: linoleic acid
Target: Prostaglandin G/H synthase 1 (Enzyme)
Gene: PTGS1
UniProt: P23219 (PGH1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.89
Assay: Inhibition of COX1
Drug: linoleic acid
Target: Aromatase (Enzyme)
Gene: CYP19A1
UniProt: P11511 (CP19A_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.32
Assay: Inhibition of aromatase in human placental microsomes by radiometric method
Drug: linoleic acid
Target: Peroxisome proliferator-activated receptor alpha (Nuclear hormone receptor)
Gene: PPARA
UniProt: Q07869 (PPARA_HUMAN)
Organism: Homo sapiens
Activity: Kd = 8.32
Assay: Binding affinity to PPAR-alpha (unknown origin) by fluorescence-based assay
Drug: linoleic acid
Target: Peroxisome proliferator-activated receptor gamma (Nuclear hormone receptor)
Gene: PPARG
UniProt: P37231 (PPARG_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.21
Assay: Displacement of [3H]BRL49653 from Homo sapiens (human) PPARgamma receptor by scintillation proximity assay
Drug: linoleic acid
Target: Fatty acid-binding protein, adipocyte (Cytosolic other)
Gene: FABP4
UniProt: P15090 (FABP4_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6
Assay: Displacement of 8-anilino-1-naphthalene-sulfonic acid from human His-FABP4 expressed in Escherichia coli BL21 (DE3) cells after 3 mins relative to linoleic acid
Drug: linoleic acid
Target: Fatty acid-binding protein, heart (Cytosolic other)
Gene: FABP3
UniProt: P05413 (FABPH_HUMAN)
Organism: Homo sapiens
Activity: Kd = 9.7
Assay: Binding affinity to human FABP3 expressed in Escherichia coli BL21 (DE3) in DMPC liposomes by surface plasmon resonance analysis
Drug: linoleic acid
Target: Peroxisome proliferator-activated receptor delta (Nuclear hormone receptor)
Gene: PPARD
UniProt: Q03181 (PPARD_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5
Assay: Displacement of [3H]GW2433 from Homo sapiens (human) PPARdelta receptor by scintillation proximity assay
Drug: linoleic acid
Target: Free fatty acid receptor 1 (GPCR)
Gene: FFAR1
UniProt: O14842 (FFAR1_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.7
Action type: AGONIST
Drug: linoleic acid
Target: Potassium voltage-gated channel subfamily B member 1 (Ion channel)
Gene: KCNB1
UniProt: Q14721 (KCNB1_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.6
Action type: ACTIVATOR
Drug: linoleic acid
Target: Adenosine receptor A1 (GPCR)
Gene: Adora1
UniProt: P25099 (AA1R_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 4.19
Assay: Displacement of [3H]DPCPX from rat adenosine A1 receptor by liquid scintillation counting
Drug: linoleic acid
Target: Seed linoleate 13S-lipoxygenase-1 (Enzyme)
Gene: LOX1.1
UniProt: P08170 (LOX1_SOYBN)
Organism: Glycine max
Activity: IC50 = 6
Assay: Allosteric inhibition of soybean LO1
Drug: linoleic acid
Target: Tissue factor (Membrane receptor)
Gene: F3
UniProt: P13726 (TF_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.39
Assay: Inhibition of amidolytic activity of human tissue factor/human factor 7a
Drug: linoleic acid
Target: Prostaglandin G/H synthase 2 (Enzyme)
Gene: PTGS2
UniProt: P79208 (PGH2_SHEEP)
Organism: Ovis aries
Activity: IC50 = 4.03
Assay: Inhibition of sheep COX2-mediated prostaglandin biosynthesis using [1-14C]arachidonic acid
Drug: linoleic acid
Target: Free fatty acid receptor 4 (GPCR)
Gene: FFAR4
UniProt: Q5NUL3 (FFAR4_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.89
Action type: AGONIST
Drug: lodoxamide
Target: G-protein coupled receptor 35 (GPCR)
Gene: GPR35
UniProt: Q9HC97 (GPR35_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 8.793
Action type: AGONIST
Assay: GPR35a–beta-arrestin-2 interaction assays performed using a CHO–K1 cell line stably expressing human GPR35 and beta-arrestin-2
Drug: lubeluzole
Target: Sodium channel protein type 2 subunit alpha (Ion channel)
Gene: Scn2a
UniProt: P04775 (SCN2A_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 6.59
Assay: In vitro inhibition of [14C]- guanidinium influx in Chinese hamster ovary (CHO) cells expressing rat brain sodium channel type IIA (CNaIIA-1)
Drug: lubeluzole
Target: Calmodulin (Cytosolic other)
Gene: CALM
UniProt: P62157 (CALM_BOVIN)
Organism: Bos taurus
Activity: Kd = 5.54
Assay: Binding affinity to bovine brain CaM by FTPFACE analysis
Drug: mestanolone
Target: Androgen receptor (Nuclear hormone receptor)
Gene: AR
UniProt: P10275 (ANDR_HUMAN)
Organism: Homo sapiens
Action type: AGONIST
Assay: Mechanism of Action
Drug: mestanolone
Target: Sex hormone-binding globulin (Secreted)
Gene: SHBG
UniProt: P04278 (SHBG_HUMAN)
Organism: Homo sapiens
Activity: Kd = 8.81
Assay: Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulin
Drug: mesterolone
Target: Sex hormone-binding globulin (Secreted)
Gene: SHBG
UniProt: P04278 (SHBG_HUMAN)
Organism: Homo sapiens
Activity: Kd = 9.6
Assay: Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulin
Drug: mesterolone
Target: Androgen receptor (Transcription factor)
Gene: Ar
UniProt: P15207 (ANDR_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 4.74
Assay: Displacement of fluormone-AL Green from recombinant rat His-tagged/GST-fused androgen receptor LBD expressed in baculovirus expression system measured after 1.5 hrs by fluorescence polarization assay
Drug: methionine
Target: S-ribosylhomocysteine lyase (Unclassified)
Gene: luxS
UniProt: O34667 (LUXS_BACSU)
Organism: Bacillus subtilis (strain 168)
Activity: Ki = 4.21
Assay: Inhibition of cobalt substituted Bacillus subtilis LuxS
Drug: methyltestosterone
Target: Glucocorticoid receptor (Nuclear hormone receptor)
Gene: NR3C1
UniProt: P04150 (GCR_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.077
Assay: DRUGMATRIX: Glucocorticoid radioligand binding (ligand: [3H] Dexamethasone)
Drug: methyltestosterone
Target: Androgen receptor (Nuclear hormone receptor)
Gene: AR
UniProt: P10275 (ANDR_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 9.66
Action type: AGONIST
Assay: 22Rv1 human prostate cells transfected with hAR and luciferase reporter plasmid driven by the androgen response element.
Drug: methyltestosterone
Target: Sex hormone-binding globulin (Secreted)
Gene: SHBG
UniProt: P04278 (SHBG_HUMAN)
Organism: Homo sapiens
Activity: Kd = 8.43
Assay: Displacement of [3H]5alpha dihydrotestosterone from human sex hormone binding globulin
Drug: methyltestosterone
Target: Androgen receptor (Transcription factor)
Gene: Ar
UniProt: P15207 (ANDR_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 7.8
Assay: Inhibitory concentration against recombinant rat androgen receptor expressed in Escherichia coli using [3H]methyltrienolone (R 1881)
Drug: methyltestosterone
Target: Progesterone receptor (Transcription factor)
Gene: PGR
UniProt: Q690N0 (Q690N0_BOVIN)
Organism: Bos taurus
Activity: Ki = 7.481
Assay: DRUGMATRIX: Progesterone radioligand binding (ligand: [3H] R-5020)
Drug: mitoguazone
Target: S-adenosylmethionine decarboxylase proenzyme (Enzyme)
Gene: Amd1
UniProt: P17708 (DCAM_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 6
Assay: Inhibitory concentration of compound against S-Adenosyl-methionine decarboxylase (SAMDC) from rat liver
Drug: mitoguazone
Target: Amiloride-sensitive amine oxidase [copper-containing] (Enzyme)
Gene: Aoc1
UniProt: P36633 (AOC1_RAT)
Organism: Rattus norvegicus
Activity: IC50 = 5.82
Assay: In vitro inhibition of Diamine oxidase (DAO) from rat small intestine.
Drug: moxestrol
Target: Estrogen receptor (Nuclear hormone receptor)
Gene: ESR1|ESR2
UniProt: P03372|Q92731 (ESR1_HUMAN|ESR2_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 8.6
Assay: Binding affinity for estrogen receptor of rabbit uterine skeletal muscle tissue
Drug: naphazoline
Target: Alpha-2A adrenergic receptor (GPCR)
Gene: ADRA2A
UniProt: P08913 (ADA2A_HUMAN)
Organism: Homo sapiens
Activity: Ki = 7.68
Action type: AGONIST
Drug: naphazoline
Target: Alpha-2B adrenergic receptor (GPCR)
Gene: ADRA2B
UniProt: P18089 (ADA2B_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.39
Action type: AGONIST
Drug: naphazoline
Target: Alpha-2C adrenergic receptor (GPCR)
Gene: ADRA2C
UniProt: P18825 (ADA2C_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.39
Action type: AGONIST
Drug: naphazoline
Target: Nischarin (Membrane receptor)
Gene: NISCH
UniProt: Q9Y2I1 (NISCH_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.92
Assay: Displacement of [125I]PIC from human imidazoline receptor 1 in human platelets analyzed under norepinephrine mask of alpha 2AR
Drug: naphazoline
Target: Nischarin (Unclassified)
Gene: Nisch
UniProt: Q4G017 (NISCH_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.61
Assay: Binding affinity to I1 imidazoline binding site in Rattus norvegicus (rat) PC12 cells
Drug: naphazoline
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 = 8.24
Assay: Displacement of [3H]clonidine from Alpha-2 adrenergic receptor of rat brain membranes
Drug: naphazoline
Target: Adrenergic receptor alpha-1 (GPCR)
Gene: Adra1b|Adra1d|Adra1a
UniProt: P15823|P23944|P43140 (ADA1B_RAT|ADA1D_RAT|ADA1A_RAT)
Organism: Rattus norvegicus
Activity: EC50 = 7.92
Assay: Compound was evaluated for Adrenergic activity against Alpha-1 adrenergic receptor from rat aorta
Drug: naphazoline
Target: Adrenergic receptor alpha (GPCR)
Gene: Adra1b|Adra2b|Adra2c|Adra2a|Adra1d|Adra1a
UniProt: P15823|P19328|P22086|P22909|P23944|P43140 (ADA1B_RAT|ADA2B_RAT|ADA2C_RAT|ADA2A_RAT|ADA1D_RAT|ADA1A_RAT)
Organism: Rattus norvegicus
Activity: Ki = 8.24
Assay: Displacement of [3H]clonidine from alpha-adrenergic receptor in rat brain
Drug: neridronic acid
Target: Farnesyl pyrophosphate synthase (Enzyme)
Gene: FDPS
UniProt: P14324 (FPPS_HUMAN)
Organism: Homo sapiens
Activity: Ki = 7.2
Assay: Inhibition of human recombinant FPPS expressed in Escherichia coli BL21 after 10 mins
Drug: nifenalol
Target: Beta-2 adrenergic receptor (GPCR)
Gene: ADRB2
UniProt: Q28044 (ADRB2_BOVIN)
Organism: Bos taurus
Activity: Kd = 5.88
Assay: Affinity for cow beta-2 adrenergic receptor by measuring displacement (-)-[3H]dihydroalprenolol (DHA)
Drug: octopamine
Target: 5-hydroxytryptamine receptor 3A (Ion channel)
Gene: HTR3A
UniProt: P46098 (5HT3A_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 7.62
Assay: Activity at SER3 receptor expressed in HEK293 cells assessed as increase in calcium by calcium imaging assay
Drug: octopamine
Target: Trace amine-associated receptor 1 (GPCR)
Gene: TAAR1
UniProt: Q96RJ0 (TAAR1_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.8
Action type: AGONIST
Drug: octopamine
Target: Trace amine-associated receptor 1 (GPCR)
Gene: Taar1
UniProt: Q923Y9 (TAAR1_RAT)
Organism: Rattus norvegicus
Activity: EC50 = 5.9
Action type: AGONIST
Drug: octopamine
Target: Trace amine-associated receptor 1 (GPCR)
Gene: Taar1
UniProt: Q923Y8 (TAAR1_MOUSE)
Organism: Mus musculus
Activity: EC50 = 5.8
Action type: AGONIST
Drug: octopamine
Target: TyR1 (GPCR)
UniProt: H9TVJ1 (H9TVJ1_9NEOP)
Organism: Chilo suppressalis
Activity: EC50 = 6.01
Assay: Agonist activity at Chilo suppressalis (rice stem borer) tyramine receptor TyR1 expressed in HEK293 cells assessed as reduction in forskolin-induced cAMP accumulation incubated for 20 min
Drug: oleandrin
Target: Neurogenic locus notch homolog protein 1 (Unclassified)
Gene: Notch1
UniProt: Q01705 (NOTC1_MOUSE)
Organism: Mus musculus
Activity: IC50 = 6.92
Assay: Inhibition of recombinant mouse N-terminal FLAG-tagged Notch1 (1704 to 2531 residues) expressed in human LS174T cells assessed as reduction in doxycycline-induced NICD expression after 12 hrs by Bright-Glo luciferase reporter gene assay
Drug: oleic acid
Target: Fatty-acid amide hydrolase 1 (Enzyme)
Gene: FAAH
UniProt: O00519 (FAAH1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.22
Assay: Inhibition of FAAH
Drug: oleic acid
Target: Aromatase (Enzyme)
Gene: CYP19A1
UniProt: P11511 (CP19A_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.49
Assay: Inhibition of aromatase in human placental microsomes by radiometric method
Drug: oleic acid
Target: Peroxisome proliferator-activated receptor alpha (Nuclear hormone receptor)
Gene: PPARA
UniProt: Q07869 (PPARA_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6.22
Assay: Inhibition of PPAR-alpha (unknown origin) by SPA assay
Drug: oleic acid
Target: Peroxisome proliferator-activated receptor gamma (Nuclear hormone receptor)
Gene: PPARG
UniProt: P37231 (PPARG_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.39
Assay: Displacement of [3H]BRL49653 from Homo sapiens (human) PPARgamma receptor by scintillation proximity assay
Drug: oleic acid
Target: Fatty acid-binding protein, adipocyte (Cytosolic other)
Gene: FABP4
UniProt: P15090 (FABP4_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.73
Assay: Displacement of 1,8-ANS from aFABP by fluorescence based-assay
Drug: oleic acid
Target: DNA topoisomerase 1 (Enzyme)
Gene: TOP1
UniProt: P11387 (TOP1_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.51
Assay: Inhibition of DNA topoisomerase 1
Drug: oleic acid
Target: Telomerase reverse transcriptase (Enzyme)
Gene: TERT
UniProt: O14746 (TERT_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.07
Drug: oleic acid
Target: Fatty acid-binding protein, epidermal (Cytosolic other)
Gene: FABP5
UniProt: Q01469 (FABP5_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.61
Assay: Displacement of 1,8-ANS from eFABP by fluorescence based-assay
Drug: oleic acid
Target: Peroxisome proliferator-activated receptor delta (Nuclear hormone receptor)
Gene: PPARD
UniProt: Q03181 (PPARD_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.28
Assay: Displacement of [3H]GW2433 from Homo sapiens (human) PPARdelta receptor by scintillation proximity assay
Drug: oleic acid
Target: Free fatty acid receptor 1 (GPCR)
Gene: FFAR1
UniProt: O14842 (FFAR1_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 5.7
Action type: AGONIST
Drug: oleic acid
Target: Fatty acid-binding protein, liver (Unclassified)
Gene: FABP1
UniProt: P07148 (FABPL_HUMAN)
Organism: Homo sapiens
Activity: Kd = 6.7
Assay: Binding affinity to L-FABP high binding affinity site by titration calorimetry method
Drug: oleic acid
Target: Fatty acid-binding protein, liver (Unclassified)
Gene: Fabp1
UniProt: P02692 (FABPL_RAT)
Organism: Rattus norvegicus
Activity: Ki = 6.74
Assay: Displacement of 1-anilinonaphthalene-8-sulphonic acid from rat recombinant L-FABP high binding affinity site expressed in Escherichia coli BL21 by competitive fluorescence displacement assay
Drug: oleic acid
Target: Seed linoleate 13S-lipoxygenase-1 (Enzyme)
Gene: LOX1.1
UniProt: P08170 (LOX1_SOYBN)
Organism: Glycine max
Activity: Ki = 4.66
Assay: Binding affinity to soybean LO1
Drug: oleic acid
Target: Tissue factor (Membrane receptor)
Gene: F3
UniProt: P13726 (TF_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 4.1
Assay: Inhibition of amidolytic activity of human tissue factor/human factor 7a
Drug: oleic acid
Target: Free fatty acid receptor 4 (GPCR)
Gene: FFAR4
UniProt: Q5NUL3 (FFAR4_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 4.7
Action type: AGONIST
Drug: ornithine
Target: G-protein coupled receptor family C group 6 member A (GPCR)
Gene: GPRC6A
UniProt: Q5T6X5 (GPC6A_HUMAN)
Organism: Homo sapiens
Activity: EC50 = 4
Action type: AGONIST
Drug: oxetacaine
Target: Sodium channel alpha subunits; brain (Types I, II, III) (Ion channel)
Gene: SCN1A|SCN2A|SCN3A
UniProt: P35498|Q99250|Q9NY46 (SCN1A_HUMAN|SCN2A_HUMAN|SCN3A_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.64
Assay: Inhibition of binding of Batrachotoxinin [3H]BTX-B to high affinity sites on voltage dependent sodium channels in a vesicular preparation from guinea pig cerebral cortex
Drug: oxiconazole
Target: D(1A) dopamine receptor (GPCR)
Gene: DRD1
UniProt: P21728 (DRD1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.684
Assay: DRUGMATRIX: Dopamine D1 radioligand binding (ligand: [3H] SCH-23390)
Drug: oxiconazole
Target: Alpha-2A adrenergic receptor (GPCR)
Gene: ADRA2A
UniProt: P08913 (ADA2A_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.815
Assay: DRUGMATRIX: Alpha-2A adrenergic receptor radioligand binding (ligand: MK-912)
Drug: oxiconazole
Target: Cytochrome P450 3A4 (Enzyme)
Gene: CYP3A4
UniProt: P08684 (CP3A4_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 7.046
Assay: DRUGMATRIX: CYP450, 3A4 enzyme inhibition (substrate: 7-Benzyloxy-4-(trifluoromethyl)-coumarin)
Drug: oxiconazole
Target: Sodium-dependent serotonin transporter (Transporter)
Gene: SLC6A4
UniProt: P31645 (SC6A4_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.372
Assay: DRUGMATRIX: Transporter, Serotonin (5-Hydroxytryptamine) (SERT) radioligand binding (ligand: [3H] Paroxetine)
Drug: oxiconazole
Target: Sodium-dependent noradrenaline transporter (Transporter)
Gene: SLC6A2
UniProt: P23975 (SC6A2_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.723
Assay: DRUGMATRIX: Norepinephrine Transporter radioligand binding (ligand: [125I] RTI-55)
Drug: oxiconazole
Target: 5-hydroxytryptamine receptor 1A (GPCR)
Gene: HTR1A
UniProt: P08908 (5HT1A_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.497
Assay: DRUGMATRIX: Serotonin (5-Hydroxytryptamine) 5-HT1A radioligand binding (ligand: [3H] 8-OH-DPAT)
Drug: oxiconazole
Target: 5-hydroxytryptamine receptor 2A (GPCR)
Gene: HTR2A
UniProt: P28223 (5HT2A_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.925
Assay: DRUGMATRIX: Serotonin (5-Hydroxytryptamine) 5-HT2A radioligand binding (ligand: [3H] Ketanserin)
Drug: oxiconazole
Target: 5-hydroxytryptamine receptor 2B (GPCR)
Gene: HTR2B
UniProt: P41595 (5HT2B_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.533
Assay: DRUGMATRIX: Serotonin (5-Hydroxytryptamine) 5-HT2B radioligand binding (ligand: [3H] Lysergic acid diethylamide)
Drug: oxiconazole
Target: Alpha-2B adrenergic receptor (GPCR)
Gene: ADRA2B
UniProt: P18089 (ADA2B_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.778
Assay: DRUGMATRIX: Alpha-2B adrenergic receptor radioligand binding (ligand: Rauwolscine)
Drug: oxiconazole
Target: D(3) dopamine receptor (GPCR)
Gene: DRD3
UniProt: P35462 (DRD3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.169
Assay: DRUGMATRIX: Dopamine D3 radioligand binding (ligand: [3H] Spiperone)
Drug: oxiconazole
Target: Muscarinic acetylcholine receptor M1 (GPCR)
Gene: CHRM1
UniProt: P11229 (ACM1_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.943
Assay: DRUGMATRIX: Muscarinic M1 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: oxiconazole
Target: Muscarinic acetylcholine receptor M3 (GPCR)
Gene: CHRM3
UniProt: P20309 (ACM3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.018
Assay: DRUGMATRIX: Muscarinic M3 radioligand binding (ligand: [3H] N-Methylscopolamine)
Drug: oxiconazole
Target: Beta-3 adrenergic receptor (GPCR)
Gene: ADRB3
UniProt: P13945 (ADRB3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.449
Assay: DRUGMATRIX: Adrenergic beta3 radioligand binding (ligand: [125I] Cyanopindolol)
Drug: oxiconazole
Target: Alpha-2C adrenergic receptor (GPCR)
Gene: ADRA2C
UniProt: P18825 (ADA2C_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.218
Assay: DRUGMATRIX: Adrenergic Alpha-2C radioligand binding (ligand: [3H] MK-912)
Drug: oxiconazole
Target: Sodium-dependent dopamine transporter (Transporter)
Gene: SLC6A3
UniProt: Q01959 (SC6A3_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.676
Assay: DRUGMATRIX: Dopamine Transporter radioligand binding (ligand: [125I] RTI-55)
Drug: oxiconazole
Target: Cytochrome P450 2D6 (Enzyme)
Gene: CYP2D6
UniProt: P10635 (CP2D6_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 6
Assay: DRUGMATRIX: CYP450, 2D6 enzyme inhibition (substrate: 3-Cyano-7-ethoxycoumarin)
Drug: oxiconazole
Target: Adenosine receptor A3 (GPCR)
Gene: ADORA3
UniProt: P0DMS8 (AA3R_HUMAN)
Organism: Homo sapiens
Activity: Ki = 6.445
Assay: DRUGMATRIX: Adenosine A3 radioligand binding (ligand: AB-MECA)
Drug: oxiconazole
Target: Lanosterol 14-alpha demethylase (Enzyme)
Gene: ERG11
UniProt: P10613 (CP51_CANAL)
Organism: Candida albicans (strain SC5314 / ATCC MYA-2876)
Action type: INHIBITOR
Assay: Mechanism of Action; CHEMBL1780; SINGLE PROTEIN
Drug: oxiconazole
Target: Delta-type opioid receptor (GPCR)
Gene: OPRD1
UniProt: P41143 (OPRD_HUMAN)
Organism: Homo sapiens
Activity: Ki = 5.728
Assay: DRUGMATRIX: Opiate delta1 (OP1, DOP) radioligand binding (ligand: [3H] Naltrindole)
Drug: oxiconazole
Target: Acetylcholinesterase (Enzyme)
Gene: ACHE
UniProt: P22303 (ACES_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.333
Assay: DRUGMATRIX: Acetylcholinesterase enzyme inhibition (substrate: acetylthiocholine)
Drug: oxiconazole
Target: Cytochrome P450 2C9 (Enzyme)
Gene: CYP2C9
UniProt: P11712 (CP2C9_HUMAN)
Organism: Homo sapiens
Activity: IC50 = 5.523
Assay: DRUGMATRIX: CYP450, 2C9 enzyme inhibition (substrate: 3-Cyano-7-ethoxycoumarin)