Metabolic pathways are enzyme-mediated biochemical reactions that lead to biosynthesis (anabolism) or breakdown (catabolism) of natural product small molecules within a cell or tissue. In each pathway, enzymes catalyze the conversion of substrates into structurally similar products. Metabolic processes typically transform small molecules, but also include macromolecular processes such as DNA repair and replication, and protein synthesis and degradation. Metabolism maintains the living state of the cells and the organism.

Proteases are used throughout an organism for various metabolic processes. Proteases control a great variety of physiological processes that are critical for life, including the immune response, cell cycle, cell death, wound healing, food digestion, and protein and organelle recycling. On the basis of the type of the key amino acid in the active site of the protease and the mechanism of peptide bond cleavage, proteases can be classified into six groups: cysteine, serine, threonine, glutamic acid, aspartate proteases, as well as matrix metalloproteases. Proteases can not only activate proteins such as cytokines, or inactivate them such as numerous repair proteins during apoptosis, but also expose cryptic sites, such as occurs with β-secretase during amyloid precursor protein processing, shed various transmembrane proteins such as occurs with metalloproteases and cysteine proteases, or convert receptor agonists into antagonists and vice versa such as chemokine conversions carried out by metalloproteases, dipeptidyl peptidase IV and some cathepsins. In addition to the catalytic domains, a great number of proteases contain numerous additional domains or modules that substantially increase the complexity of their functions.

Imbalances in metabolic activities have been found to be critical in a number of pathologies, such as cardiovascular diseases, inflammation, cancer, and neurodegenerative diseases.

References:
[1] Turk B, et al. EMBO J. 2012 Apr 4;31(7):1630-43.
[2] Eatemadi A, et al. Biomed Pharmacother. 2017 Feb;86:221-231.


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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
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NAcM-OPT

NAcM-OPT is an orally bioavailable cullin neddylation 1 (DCN1) inhibitor, which potently inhibits the DCN1-UBE2M interaction[1].

  • CAS Number: 2089293-61-6
  • MF: C23H29Cl2N3O
  • MW: 434.40
  • Catalog: NEDD8-activating Enzyme
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

TP0463518

TP0463518 is a potent hypoxia-inducible factor prolyl hydroxylases (PHDs) inhibitor with a Ki value of 5.3 nM for human PHD2. TP0463518 also inhibits human PHD1/PHD3 with IC50s of 18 and 63 nM as well as monkey PHD2 with an IC50 value of 22 nM[1].

  • CAS Number: 1558021-37-6
  • MF: C20H18ClN3O6
  • MW: 431.83
  • Catalog: HIF/HIF Prolyl-Hydroxylase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Carfilzomib-d8

Carfilzomib-d8 is deuterium labeled Carfilzomib. Carfilzomib (PR-171) is an irreversible proteasome inhibitor with an IC50 of 5 nM in ANBL-6 and RPMI 8226 cells.

  • CAS Number: 1537187-53-3
  • MF: C40H49D8N5O7
  • MW: 727.96
  • Catalog: Apoptosis
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 975.6±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 543.8±34.3 °C

MMP-8/MMP-26 Fluorogenic Substrate

Dnp-PLAYWAR is a fluorogenic substrate for matrix metalloproteinase-8 (MMP-8) and MMP-26.The activity of MMP-8 and MMP-26 can be quantified by measuring tryptophan fluorescence that is unquenched upon peptide hydrolysis that removes the N-terminal dinitro

  • CAS Number: 135662-05-4
  • MF: C49H63N13O13
  • MW: 1042.1
  • Catalog: MMP
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Tetrahydrocurcumin D6

Tetrahydrocurcumin D6 (HZIV 81-2 D6) is a deuterium labeled Tetrahydrocurcumin. Tetrahydrocurcumin is a Curcuminoid which displays inhibitory activity for CYP2C9 and CYP3A4[1].

  • CAS Number: 1794898-13-7
  • MF: C21H18D6O6
  • MW: 378.45
  • Catalog: Autophagy
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Thrombin

Thrombin is a trypsin-like allosteric serine protease that has a fundamental role in the clotting cascade.

  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

YM-53601 free base

YM-53601 free base is a squalene synthetase inhibitor which suppresses lipogenic biosynthesis and lipid secretion in rodents.

  • CAS Number: 182959-28-0
  • MF: C21H21FN2O
  • MW: 336.403
  • Catalog: Farnesyl Transferase
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 541.2±40.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 281.1±27.3 °C

Diprophylline

Dyphylline acts as an adenosine receptor antagonist and phosphodiesterase inhibitor, which is used in the treatment of respiratory disorders.Target: Adenosine Receptor; PDEDyphylline (trade names Dilor, Lufyllin), also known as diprophylline, is a xanthine derivative with bronchodilator and vasodilator effects. It is used in the treatment of respiratory disorders like asthma, cardiac dyspnea, and bronchitis. It acts as an adenosine receptor antagonist and phosphodiesterase inhibitor.

  • CAS Number: 479-18-5
  • MF: C10H14N4O4
  • MW: 254.243
  • Catalog: Adenosine Receptor
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 589.6±60.0 °C at 760 mmHg
  • Melting Point: 161-162 °C(lit.)
  • Flash Point: 310.4±32.9 °C

Pectolinarigenin

Pectolinarigenin, isolated from Cirsium chanroenicum, is a dual inhibitor of COX-2/5-LOX. Anti-inflammatory activity[1]. Pectolinarigenin has potent inhibitory activities on melanogenesis[2].

  • CAS Number: 520-12-7
  • MF: C17H14O6
  • MW: 314.289
  • Catalog: COX
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 565.5±50.0 °C at 760 mmHg
  • Melting Point: 220-223°
  • Flash Point: 212.3±23.6 °C

PF-06795071

PF-06795071 is a potent and selective covalent MAGL inhibitor with an IC50 of 3 nM[1].

  • CAS Number: 2075629-81-9
  • MF: C18H17F4N3O3
  • MW: 399.34
  • Catalog: MAGL
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Azo-Resveratrol

Azo-resveratrol, an Azo compound, inhibits Mushroom tyrosinase (IC50=36.28 μM).

  • CAS Number: 1393556-48-3
  • MF: C12H10N2O3
  • MW: 230.219
  • Catalog: Tyrosinase
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 488.5±28.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 324.6±13.3 °C

BAY-60-7550

Bay 60-7550 is a potent and selective PDE2 inhibitor with a Ki of 3.8 nM.

  • CAS Number: 439083-90-6
  • MF: C27H32N4O4
  • MW: 476.56700
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Dual FAAH/sEH-IN-1

Dual FAAH/sEH-IN-1 (compound 3) is a high affinity dual sEH (soluble epoxide hydrolase) and FAAH (fatty acid amide hydrolase) inhibitor, with IC50 values of 9.6 and 7 nM, respectively. Dual FAAH/sEH-IN-1 shows antinociception against the inflammatory phase[1].

  • CAS Number: 2756099-59-7
  • MF: C25H22ClN3O3S2
  • MW: 512.04
  • Catalog: FAAH
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

27-Hydroxycholesterol

27-Hydroxycholesterol is a selective estrogen receptor modulator and an agonist of the liver X receptor.

  • CAS Number: 20380-11-4
  • MF: C27H46O2
  • MW: 402.653
  • Catalog: LXR
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 517.1±23.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 215.6±17.2 °C

Liarozole dihydrochloride

Liarozole dihydrochloride (R75251; R85246) is a cytochrome P450 (CYP450) dependent inhibitor, orally active, it also a potent inhibitor of estrogen (via inhibition of aromatase) and testicular androgen synthesis (inhibition of 17 ,20-lyase). Liarozole dihydrochloride prevents the catabolism of retinoic acid via inhibition of 4-hydroxylase and exhibits retinoid sparing and retinoid-mimetic effects in vivo. Liarozole dihydrochloride is an imidazole derivative; it is being investigated as a non-hormonal agent in prostate cancer and in the treatment of various other cancers and skin disorders[1].

  • CAS Number: 1883548-96-6
  • MF: C17H15Cl3N4
  • MW: 381.69
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

LG 100754

LG100754 (UVI 2112) is a RXR dimers modulater. LG100754 acts as a RXR:RXR homodimer antagonist, but functions as a agonist towards RXR:PPARα and RXR:PPARγ heterodimers. LG100754 is an insulin sensitizer that functions through RXR[1].

  • CAS Number: 180713-37-5
  • MF: C26H36O3
  • MW: 396.56200
  • Catalog: RAR/RXR
  • Density: 1.003g/cm3
  • Boiling Point: 549.4ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 178.5ºC

Deltasonamide 1

A novel small molecule inhibitor of PDE6δ/KRas interaction with Kd of 203 pM; inhibits PDE6δ/KRas interaction in cells with Kd of 85 nM, selectively inhibits growth of KRas mutated and -dependent cells.

  • CAS Number: 2088485-33-8
  • MF: C30H39ClN6O4S2
  • MW: 647.25
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MLS000544460

MLS000544460 is a highly selective and reversible Eya2 phosphatase inhibitor with a Kd of 2.0 μM and an IC50 of 4 μM. MLS000544460 inhibit Eya2 phosphatase mediated cell migration and has anti-cancer activity[1].

  • CAS Number: 352336-36-8
  • MF: C17H12FN3O2S
  • MW: 341.36
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BI-6C9

BI-6C9 is a BH3 interacting domain (Bid) inhibitor, which prevents mitochondrial outer membrane potential (MOMP) and mitochondrial fission, and protects the cells from cell death[1].

  • CAS Number: 791835-21-7
  • MF: C23H25N3O4S2
  • MW: 471.59200
  • Catalog: Mitochondrial Metabolism
  • Density: 1.368g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Raphin1 acetate

Raphin1 acetate is an orally bioavailable, selective inhibitor of the regulatory phosphatase PPP1R15B (R15B). Raphin1 acetate binds strongly to the R15B-PP1c holophosphatase (Kd=33 nM), and shows ~30-fold selective in binding R15B-PP1c over R15A-PP1c. Raphin1 acetate crosses the blood-brain barrier, and reduces organismal and molecular deficits in a mouse model of a protein misfolding disease[1].

  • CAS Number: 2242616-04-0
  • MF: C10H12Cl2N4O2
  • MW: 291.13
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

quinine hydrobromide

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

  • CAS Number: 549-49-5
  • MF: C20H25BrN2O2
  • MW: 405.32900
  • Catalog: Potassium Channel
  • Density: 1.21g/cm3
  • Boiling Point: 495.9ºC at 760mmHg
  • Melting Point: 81-82ºC
  • Flash Point: 253.7ºC

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

Bunaprolast

U66858 is a potent inhibitor of LTB4 production in human whole blood. U66858 also exhibits significant inhibition of lipoxygenase and TXB2 release.

  • CAS Number: 99107-52-5
  • MF: C17H20O3
  • MW: 272.33900
  • Catalog: Prostaglandin Receptor
  • Density: 1.084g/cm3
  • Boiling Point: 413ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 175.3ºC

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

TPN729

TPN729 is a novel potent, selective phosphodiesterase type 5 (PDE5) inhibitor with IC50 of 2.28 nM, shows better selectivity profile 2.5 times higher than sildenafil against PDE6 and 500 times higher than tadalafil against PDE11; selectively inhibits PDE5 and blocks the degradation of cyclic guanosine monophosphate, and is a promising PDE5 inhibitor providing fewer side effects and better compliance.

  • CAS Number: 936951-20-1
  • MF: C25H36N6O4S
  • MW: 516.661
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Asp-AMS

Asp-AMS, an analogue of aspartyl-adenylate, is an aspartyl-tRNA synthetase inhibitor and also a strong competitive inhibitor of the mitochondrial enzyme.

  • CAS Number: 828288-98-8
  • MF: C14H19N7O9S
  • MW: 461.41
  • Catalog: Mitochondrial Metabolism
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Lopinavir Metabolite M-1

Lopinavir Metabolite M-1, an active metabolite of Lopinavir, inhibits HIV protease with a Ki of 0.7 pM. Lopinavir Metabolite M-1 has antiviral activities in vitro[1][2].

  • CAS Number: 192725-39-6
  • MF: C37H46N4O6
  • MW: 642.78400
  • Catalog: HIV Protease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

DCN1-UBC12-IN-1

DCN1-UBC12-IN-1 is potent and selective DCN1-UBC12 inhibitor with an IC50 of 2.86 nM. Anticardiac fibrotic effect[1].

  • CAS Number: 2374827-31-1
  • MF: C24H23N7O3S2
  • MW: 521.61
  • Catalog: E1/E2/E3 Enzyme
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

p-aminophenylmercuric acetate

p-Aminophenylmercuric acetate is an organomercurial activator of matrix metalloproteinases (MMP). P-Aminophenylmercuric acetate participates in the activation and inhibition of MMP-8 by attacking protein sulfhydryl or inducing cysteine switching reaction. p-Aminophenylmercuric acetate promotes the shedding of betacellulin precursor (pro-BTC). p-Aminophenylmercuric acetate influences the binding of agonists and antagonists to the opiate receptor[1][2][3].

  • CAS Number: 6283-24-5
  • MF: C8H9HgNO2
  • MW: 351.75
  • Catalog: Cathepsin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 163-165 °C(lit.)
  • Flash Point: N/A

Mca-Pro-Leu-Ala-Cys(Mob)-Trp-Ala-Arg-Dap(Dnp)-NH2 trifluoroacetate salt

Mca-Pro-Leu-Ala-Cys(Mob)-Trp-Ala-Arg-Dap(Dnp)-NH2 is a fluorogenic substrate for matrix metalloproteinase-14 (MMP-14).

  • CAS Number: 1926163-82-7
  • MF: C66H82N16O17S
  • MW: 1403.519
  • Catalog: MMP
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A