Cytochrome p450 comprises a superfamily of heme-thiolate proteins named for the spectral absorbance peak of their carbon-monoxide-bound species at 450 nm. Having been found in every class of organism, including Archaea, the p450 superfamily is believed to have originated from an ancestral gene that existed over 3 billion years ago. Repeated gene duplications have subsequently given rise to one of the largest of multigene families. These enzymes are notable both for the diversity of reactions that they catalyze and the range of chemically dissimilar substrates upon which they act. Cytochrome p450s support the oxidative, peroxidative and reductive metabolism of such endogenous and xenobiotic substrates as environmental pollutants, agrochemicals, plant allelochemicals, steroids, prostaglandins and fatty acids. In humans, Cytochrome p450s are best known for their central role in phase I drug metabolism where they are of critical importance to two of the most significant problems in clinical pharmacology: drug interactions and interindividual variability in drug metabolism.


Anti-infection >
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Apoptosis >
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15-PGDH 5 alpha Reductase 5-Lipoxygenase Acetyl-CoA Carboxylase Acyltransferase Adenosine Deaminase Adenosine Kinase Aldehyde Dehydrogenase (ALDH) Aldose Reductase Aminopeptidase Angiotensin-converting Enzyme (ACE) ATGL ATP Citrate Lyase Carbonic Anhydrase Carboxypeptidase Cathepsin CETP COMT Cytochrome P450 Dipeptidyl Peptidase Dopamine β-hydroxylase E1/E2/E3 Enzyme Elastase Enolase FAAH FABP Factor Xa Farnesyl Transferase Fatty Acid Synthase (FAS) FXR Glucokinase GSNOR Gutathione S-transferase HCV Protease Hexokinase HIF/HIF Prolyl-Hydroxylase HIV Integrase HIV Protease HMG-CoA Reductase (HMGCR) HSP Indoleamine 2,3-Dioxygenase (IDO) Isocitrate Dehydrogenase (IDH) Lactate Dehydrogenase LXR MAGL Mineralocorticoid Receptor Mitochondrial Metabolism MMP Nampt NEDD8-activating Enzyme Neprilysin PAI-1 PDHK PGC-1α Phosphatase Phosphodiesterase (PDE) Phospholipase Procollagen C Proteinase Proteasome Pyruvate Kinase RAR/RXR Renin ROR Ser/Thr Protease SGK Stearoyl-CoA Desaturase (SCD) Thrombin Tryptophan Hydroxylase Tyrosinase Xanthine Oxidase
Neuronal Signaling >
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NF-κB >
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Vitamin D Related >
VD/VDR
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Cholesterol 24-hydroxylase-IN-2

Cholesterol 24-hydroxylase-IN-2 is an inhibitor of cholesterol 24-hydroxylase (CH24H or CYP46A1), with the IC50 of 5.4 nM. Cholesterol 24-hydroxylase-IN-2 can be used in imaging of cholesterol 24-hydroxylase in mammals[1].

  • CAS Number: 1613481-52-9
  • MF: C20H23FN4O
  • MW: 354.42
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Obtusifoliol

Obtusifoliol is a specific CYP51 inhibitor, Obtusifoliol shows the affinity with Kd values of 1.2 µM and 1.4 µM for Trypanosoma brucei (TB) and human CYP51, respectively[1].

  • CAS Number: 16910-32-0
  • MF: C30H50O
  • MW: 426.71700
  • Catalog: Cytochrome P450
  • Density: 0.98g/cm3
  • Boiling Point: 501.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 221.9ºC

FLT3-IN-17

FLT3-IN-17 inhibits CYPs and FLT3 mutants activity (IC50s: <0.5 nM for D835Y). FLT3-IN-17 is also a FAK inhibitor, with an IC50 value of 12 nM. FLT3 ligand-2 can be used in the research of cancers[1].

  • CAS Number: 2758999-62-9
  • MF: C23H24N6O2S2
  • MW: 480.61
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

HET-0016

HET0016 is a potent and selective 20-hydroxyeicosatetraenoic acid (20-HETE) synthase inhibitor, with IC50 values of 17.7 nM, 12.1 nM and 20.6 nM for recombinant CYP4A1-, CYP4A2- and CYP4A3-catalyzed 20-HETE synthesis, respectively. HET0016 also is a selective CYP450 inhibitor, which has been shown to inhibit angiogenesis and tumor growth[1][2].

  • CAS Number: 339068-25-6
  • MF: C12H18N2O
  • MW: 206.284
  • Catalog: Cytochrome P450
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 356.9±52.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 169.7±30.7 °C

(Rac)-Brassinazole

(Rac)-Brassinazole, triazole-type compound, is a brassinosteroid (BR) biosynthesis inhibitor. (Rac)-Brassinazole increases inhibition of CYP90B in BR biosynthesis[1][2]

  • CAS Number: 224047-41-0
  • MF: C18H18ClN3O
  • MW: 327.808
  • Catalog: Cytochrome P450
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 533.1±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 276.2±32.9 °C

(3S,5S)-Atorvastatin (sodium salt)

(3S,5S)-Atorvastatin sodium salt is a pregnane X receptor (PXR) activator and the inactive enantiomer of Atorvastatin. Atorvastatin is an orally active HMG-CoA reductase inhibitor with lipid-lowering capabilities[1].

  • CAS Number: 1428118-38-0
  • MF: C33H34FN2NaO5
  • MW: 580.62
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Vildagliptin carboxylic acid metabolite (trifluoroacetate salt)

Vildagliptin carboxylic acid metabolite (M20.7) TFA is a potent P450 enzyme activity inhibitor[1].

  • CAS Number: 565453-41-0
  • MF: C19H27F3N2O6
  • MW: 436.42
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Naringin

Naringin is a major flavanone glycoside obtained from tomatoes, grapefruits, and many other citrus fruits. Naringin exhibits biological properties such as antioxidant, anti-inflammatory, and antiapoptotic activities.

  • CAS Number: 10236-47-2
  • MF: C27H32O14
  • MW: 580.53
  • Catalog: Autophagy
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 928.1±65.0 °C at 760 mmHg
  • Melting Point: 166 °C
  • Flash Point: 308.5±27.8 °C

quinidine gluconate

Quinate is an antiarrhythmic agent. Quinate is a potent, orally active, selective cytochrome P450db inhibitor. Quinate is also a K+ channel blocker with an IC50 of 19.9 μM. Quinate can be used for malaria research[1][2][3].

  • CAS Number: 7054-25-3
  • MF: C26H36N2O9
  • MW: 520.57200
  • Catalog: Potassium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 175-176ºC
  • Flash Point: N/A

Dapaconazole

Dapaconazole, as an antifungal agent, inhibits sterol 14α-demethylase cytochrome P450 activity with an IC50 of 1.4 μM[1].

  • CAS Number: 1269726-67-1
  • MF: C19H15Cl2F3N2O
  • MW: 415.236
  • Catalog: Cytochrome P450
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 512.8±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 263.9±30.1 °C

Pyributicarb

Pyributicarb, a carbamate-type herbicide, is a potent activator of both CYP3A4 gene and human pregnane X receptor (hPXR).

  • CAS Number: 88678-67-5
  • MF: C18H22N2O2S
  • MW: 330.444
  • Catalog: Cytochrome P450
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 427.8±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 212.5±31.5 °C

ONT-993

ONT-993 is an aliphatic hydroxylated metabolite. ONT-993 inhibits CYP2D6 (IC50=7.9 µM) and causes metabolism-dependent inactivation of CYP3A (KI=1.6 µM)[1].

  • CAS Number: 937263-81-5
  • MF: C26H24N8O3
  • MW: 496.52
  • Catalog: Cytochrome P450
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Chlorzoxazone

Chlorzoxazone is a centrally acting muscle relaxant used to treat muscle spasm and the resulting pain or discomfort. It acts on the spinal cord by depressing reflexes.Chlorzoxazone is currently being used as a marker substrate in vitro/vivo studies to quantify cytochrome P450 2E1 (CYP2E1) activity in humans.

  • CAS Number: 95-25-0
  • MF: C7H4ClNO2
  • MW: 169.565
  • Catalog: Autophagy
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 336.9±34.0 °C at 760 mmHg
  • Melting Point: 191-192 °C(lit.)
  • Flash Point: 157.5±25.7 °C

Mefentrifluconazole

Mefentrifluconazole is a novel azole derivative and used as an agrochemical broad-spectrum antifungal agent. Mefentrifluconazole is a potent, selective and orally active fungal CYP51 (Kd= 0.5 nM) inhibitor, but shows less inhibitory activity on human aromatase (IC50=0.92 μM)[1].

  • CAS Number: 1417782-03-6
  • MF: C18H15ClF3N3O2
  • MW: 397.77900
  • Catalog: Fungal
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Fipronil

Fipronil is an insecticide that acts as a selective antagonist of insect GABA receptors (IC50s = 30 nM and 1,600 nM for cockroach and rat receptors, respectively). Fipronil also inhibits desensitizing and non-desensitizing glutamate-induced chloride currents in cockroach neurons (IC500s = 800 nM and 10 nM, respectively). Fipronil induces activity of the cytochrome P450 (CYP) isoforms CYP1A1/2, CYP2B1/2, and CYP3A1/2 in isolated rat liver microsomes.

  • CAS Number: 120068-37-3
  • MF: C12H4Cl2F6N4OS
  • MW: 437.148
  • Catalog: GABA Receptor
  • Density: 1.9±0.1 g/cm3
  • Boiling Point: 510.1±50.0 °C at 760 mmHg
  • Melting Point: 200-201°C
  • Flash Point: 262.3±30.1 °C

epsilon-Viniferin

ε-Viniferin, the dimer of Resveratrol and isolated from Vitis vinifera, displays a potent inhibitory for all the CYP activities, with Ki values from 0.5-20 μM. ε-Viniferin possesses potent antioxidant capacity[1][2].

  • CAS Number: 62218-08-0
  • MF: C28H22O6
  • MW: 454.471
  • Catalog: Cytochrome P450
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 694.8±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 374.0±31.5 °C

FR 901537

FR 901537 is a potent and competitive aromatase inhibitor. FR 901537, a novel naphthol derivative, has the potential for breast cancer research[1].

  • CAS Number: 161162-21-6
  • MF: C23H29N3O6S2
  • MW: 507.62300
  • Catalog: Cytochrome P450
  • Density: 1.45g/cm3
  • Boiling Point: 897.3ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 496.5ºC

7-Benzyloxy-4-(trifluoromethyl)coumarin

7-Benzyloxy-4-(trifluoromethyl)coumarin (7-BFC) is a coumarin fluorescent substrate. 7-Benzyloxy-4-(trifluoromethyl)coumarin is a substrate for cDNA-expressed CYP1A2 and CYP3A4 and is metabolized to 7-hydroxy-4-trifluoromethylcoumarin (HFC). 7-Benzyloxy-4-(trifluoromethyl)coumarin is used for rapid CYP isoform metabolism and inhibition screening studies[1].

  • CAS Number: 220001-53-6
  • MF: C17H11F3O3
  • MW: 320.26300
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Curcumenol

Curcumenol is one of constituents in the plants of medicinally important genus of Curcuma[1].

  • CAS Number: 19431-84-6
  • MF: C15H22O2
  • MW: 234.33
  • Catalog: Cytochrome P450
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 349.3±42.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 146.7±22.1 °C

ginsenoside Rd

Ginsenoside Rd inhibits TNFα-induced NF-κB transcriptional activity with an IC50 of 12.05±0.82 μM in HepG2 cells. Ginsenoside Rd inhibits expression of COX-2 and iNOS mRNA. Ginsenoside Rd also inhibits Ca2+ influx. Ginsenoside Rd inhibits CYP2D6, CYP1A2, CYP3A4, and CYP2C9, with IC50s of 58.0±4.5 μM, 78.4±5.3 μM, 81.7±2.6 μM, and 85.1±9.1 μM, respectively.

  • CAS Number: 52705-93-8
  • MF: C48H82O18
  • MW: 947.154
  • Catalog: Calcium Channel
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 1015.6±65.0 °C at 760 mmHg
  • Melting Point: 207 °C(dec.)
  • Flash Point: 568.0±34.3 °C

LY43578

LY43578 is an orally active aromatase inhibitor. LY43578 inhibits P-450-dependent p-nitroanisole O-demethylation and ethylmorphine N-demethylation in hepatic microsomes isolated from rat, with the IC50 of 0.3 and 5 μΜ, respectively. LY43578 can be used for neurological disorder study[1][2].

  • CAS Number: 26766-35-8
  • MF: C17H12Cl2N2O
  • MW: 331.20
  • Catalog: Cytochrome P450
  • Density: 1.376g/cm3
  • Boiling Point: 494.9ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 253.1ºC

memantine hydrochloride

Memantine, an amantadine derivative with low to moderate-affinity for NMDA receptors, inhibit CYP2B6 and CYP2D6 with Ki of 0.51 nM and 94.9 μM, respectively..Target: NMDA Receptor, Memantine (Ebixa, Axura, Namenda, Akatinol) is a moderate-affinity, uncompetitive, voltage-dependent, NMDA-receptor antagonist with fast on/off kinetics that inhibits excessive calcium influx induced by chronic overstimulation of the NMDA receptor. Memantine is approved in the US and the EU for the treatment of patients with moderate to severe dementia of the Alzheimer's type [1]. Memantine has considerable therapeutic potential for the myriad of clinical entities associated with NMDA receptor-mediated neurotoxicity [2]. Memantine blocked 200 microM NMDA-evoked responses with a 50% inhibition constant (IC50) of approximately 1 microM at -60 mV and an empirical Hill coefficient of approximately 1 [3].

  • CAS Number: 41100-52-1
  • MF: C12H22ClN
  • MW: 215.763
  • Catalog: Autophagy
  • Density: N/A
  • Boiling Point: 239.8ºC at 760 mmHg
  • Melting Point: 292 °C
  • Flash Point: 92.3ºC

β-​Apo-​8'-​carotenal

β-Apo-8'-carotenal (Apocarotenal), a provitamin A carotenoid, is an inducer of CYPlA1 and CYPlA2 in rat. β-Apo-8'-carotenal is present in many fruits and vegetables[1].

  • CAS Number: 1107-26-2
  • MF: C30H40O
  • MW: 416.638
  • Catalog: Cytochrome P450
  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 575.7±19.0 °C at 760 mmHg
  • Melting Point: 138-141ºC
  • Flash Point: 273.8±13.8 °C

α-​Terpinyl acetate

α-Terpinyl acetate is a monoterpene ester isolated from Laurus nobilis L. essential oil. α-Terpinyl acetate is a competitive P450 2B6 substrate which binding to the active site of P450 2B6 with a Kd value of 5.4 μM[1][2].

  • CAS Number: 80-26-2
  • MF: C12H20O2
  • MW: 196.286
  • Catalog: Cytochrome P450
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 239.9±9.0 °C at 760 mmHg
  • Melting Point: 220 °C
  • Flash Point: 83.0±17.1 °C

Dihydromethysticin

Dihydromethysticin is one of the six major kavalactones found in the kava plant; has marked activity on the induction of CYP3A23.

  • CAS Number: 19902-91-1
  • MF: C15H16O5
  • MW: 276.284
  • Catalog: Cytochrome P450
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 476.1±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 214.1±28.8 °C

1-Ethynylnaphthalene

1-Ethynylnaphthalene is a selective inhibitor of cytochrome P450 1B1.

  • CAS Number: 15727-65-8
  • MF: C12H8
  • MW: 152.19200
  • Catalog: Cytochrome P450
  • Density: 1.070 g/mL at 25ºC(lit.)
  • Boiling Point: 270.4ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 106.3ºC

CDD3506

CDD3506 is used for elevating high density lipoprotein cholesterol (HDL) by inducing hepatic cytochrome P450IIIA (CYP3A) activity.

  • CAS Number: 197913-15-8
  • MF: C22H19N3
  • MW: 325.406
  • Catalog: Cytochrome P450
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 506.4±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 260.1±28.7 °C

N-Desmethyl Apalutamide

N-Desmethyl Apalutamide is an active metabolite of Apalutamide. N-Desmethyl Apalutamide is a less potent antagonist of the androgen receptor and is responsible for one-third of the activity of Apalutamide. The formation of N-Desmethyl Apalutamide mediated predominantly by CYP2C8 and CYP3A4. N-Desmethyl Apalutamide is moderate to strong CYP3A4 and CYP2B6 inducer and has an excellent plasma-proteins bound concentration[1][2][3].

  • CAS Number: 1332391-11-3
  • MF: C20H13F4N5O2S
  • MW: 463.41
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

LY56110

LY56110 is an orally active aromatase inhibitor. LY56110 inhibits P-450-dependent p-nitroanisole O-demethylation and ethylmorphine N-demethylation in hepatic microsomes isolated from rat, with the IC50 of 2.5 and 11 μΜ, respectively. LY56110 can be used for neurological disorder study[1][2].

  • CAS Number: 26766-37-0
  • MF: C17H12Cl2N2
  • MW: 315.20
  • Catalog: Cytochrome P450
  • Density: 1.296g/cm3
  • Boiling Point: 438.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 251.5ºC

20-HETE inhibitor-1

20-HETE inhibitor-1 (comp 83) is a 20-HETE formation inhibitor[1]

  • CAS Number: 2472030-28-5
  • MF: C19H24N4O
  • MW: 324.42
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A