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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Nedosiran sodium

Nedosiran sodium is a GalNAc-dsRNA conjugate designed to inhibit production of the hepatic lactate dehydrogenase (LDH) enzyme.

  • CAS Number: 2247026-22-6
  • MF:
  • MW:
  • Catalog: Lactate Dehydrogenase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Forrestiacids J

Forrestiacids J is an ATP-citrate lyase (ACL) inhibitor with an IC50 of 2.6 μM[1].

  • CAS Number: 2920898-66-2
  • MF: C50H74O6
  • MW: 771.12
  • Catalog: ATP Citrate Lyase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

D4-abiraterone

D4-abiraterone is a major metabolite of abiraterone. D4-abiraterone is an inhibitor of CYP17A1, 3b-hydroxysteroid dehydrogenase (3βHSD) and steroid-5a-reductase (SRD5A) and also an antagonist of androgen receptor.

  • CAS Number: 154229-21-7
  • MF: C24H29NO
  • MW: 347.49300
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

UCB-35440

UCB-35440, a 5-lipoxygenase inhibitor and a histamine H1 receptor antagonist, is used potentially for the treatment of dermatitis.

  • CAS Number: 299460-62-1
  • MF: C31H34ClN5O4
  • MW: 576.09
  • Catalog: Histamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Thiorphan

Thiorphan is a selective NEP (neprilysin) inhibitor with an IC50 of 6.9 nM[1].

  • CAS Number: 76721-89-6
  • MF: C12H15NO3S
  • MW: 253.32
  • Catalog: Neprilysin
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 524.0±50.0 °C at 760 mmHg
  • Melting Point: 138-140ºC
  • Flash Point: 270.7±30.1 °C

CDC25B-IN-2

CDC25B-IN-2 is a potent cdc25B inhibitor[1].

  • CAS Number: 134271-74-2
  • MF: C15H12N2O3
  • MW: 268.27
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

DHODH-IN-13

DHODH-IN-13 (Compound 7a) is a hydroxyfurazan analog of A771726. DHODH-IN-13 is a dihydroorotate dehydrogenase (DHODH) inhibitor with an IC50 of 4.3 μM for rat liver DHODH. DHODH-IN-13 can be used for rheumatoid arthritis[1].

  • CAS Number: 1364791-86-5
  • MF: C10H6F3N3O3
  • MW: 273.17
  • Catalog: DNA/RNA Synthesis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cathepsin K inhibitor 5

Cathepsin K inhibitor 5 is a potent Cathepsin K inhibitor[1].

  • CAS Number: 448945-62-8
  • MF: C35H51N7O8
  • MW: 697.82
  • Catalog: Cathepsin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ACT 178882

ACT 178882 is a new Renin inhibitor with an IC50 of 1.4 nM.

  • CAS Number: 1007392-69-9
  • MF: C33H38Cl3N3O4
  • MW: 647.031
  • Catalog: Renin
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 764.3±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 416.0±32.9 °C

Gosogliptin

Gosogliptin is a potent and selective inhibitor of dipeptidyl peptidase-IV (DPP-IV).

  • CAS Number: 869490-23-3
  • MF: C17H24F2N6O
  • MW: 366.40900
  • Catalog: Dipeptidyl Peptidase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

NQ 301

NQ301 is an antithrombotic agent; inhibits collagen-challenged rabbit platelet aggregation with an IC50 of 10 mg/mL.

  • CAS Number: 130089-98-4
  • MF: C18H12ClNO3
  • MW: 325.748
  • Catalog: Thrombin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Talarozole (R enantiomer)

Talarozole R enantiomer is a potent and selective inhibitor of cytochrome P450 26-mediated breakdown of endogenous all-trans retinoic acid for the treatment of psoriasis and acne.Target: CYP26in vitro: Talarozole R enantiomer treatment increased the mRNA expression of CRABP2, KRT4, CYP26A1 and CYP26B1 dose dependently, and decreased theexpression of KRT2 and IL-1alpha compared with vehicle-treated skin. No mRNA change in retinol-metabolizing enzymes was obtained. There was no induction of epidermal thickness or overt skin inflammation in talarozole-treated skin. Immunofluorescence analysis confirmed an upregulation of KRT4 protein, but no upregulation of CYP26A1 and CYP26B1 expression was detected [1] [2].in vivo: Talarozole R enantiomer slightly diffused into the skin only when dissolved in propylene glycol, isopropyl myristate or ethanol. Although only 0.1% of the dose applied was found in the skin itself after 12-24 h, this was sufficient to achieve local concentrations well above the half-maximal inhibitory concentration value for talarozole. The distribution of talarozole within the skin was investigated: 80% was located in the epidermis, while the remaining 20% was found in the dermis [3].

  • CAS Number: 870093-23-5
  • MF: C21H23N5S
  • MW: 377.50600
  • Catalog: Cytochrome P450
  • Density: 1.26
  • Boiling Point: 561.016ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 293.092ºC

Z-Ala-Arg-Arg-AMC hydrochloride salt

Z-Ala-Arg-Arg-AMC (Fluorogenic Proteasome Substrate) is a fluorogenic substrate for assaying trypsin-like activity of proteasome[1].

  • CAS Number: 90468-18-1
  • MF: C33H44N10O7
  • MW: 692.76500
  • Catalog: Proteasome
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Palmitic acid-1-13C

Palmitic acid-1-13C is the 13C-labeled Palmitic acid. Palmitic acid is a long-chain saturated fatty acid commonly found in both animals and plants. Palmitic acid can induce the expression of glucose-regulated protein 78 (GRP78) and CCAAT/enhancer binding protein homologous protein (CHOP) in in mouse granulosa cells[1][2].

  • CAS Number: 57677-53-9
  • MF: C1513CH32O2
  • MW: 257.41700
  • Catalog: HSP
  • Density: 0.855 g/mL at 25ºC
  • Boiling Point: 271.5ºC100 mm Hg(lit.)
  • Melting Point: 61-64ºC(lit.)
  • Flash Point: N/A

Dihydroberberine

Dihydroberberine inhibits human ether-a-go-go-related gene (hERG) channels and remarkably reduces heat shock protein 90 (Hsp90) expression and its interaction with hERG. Dihydroberberine has anti-inflammatory, anti-atherosclerotic, hypolipidemic and antitumor activities[1].

  • CAS Number: 483-15-8
  • MF: C20H19NO4
  • MW: 337.369
  • Catalog: HSP
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 557.8±50.0 °C at 760 mmHg
  • Melting Point: 223-224ºC (dec.)
  • Flash Point: 170.7±27.3 °C

Cathepsin Inhibitor 2

Cathepsin Inhibitor 2 is a potent Cathepsin S inhibitor extracted from patent WO2009123623A1, has a Ki of <20 nM.

  • CAS Number: 1017931-53-1
  • MF: C19H21F6N3O
  • MW: 421.38
  • Catalog: Cathepsin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Win-62005

Win-62005 is a cyclic AMP phosphodiesterase III (PDE III) inhibitor with Kis of 25 and 26 nM for rat heart and canine aorta, respectively.

  • CAS Number: 152633-54-0
  • MF: C12H10N4O
  • MW: 226.23400
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.292g/cm3
  • Boiling Point: 291.8ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 130.3ºC

Proteasome-IN-5

Proteasome-IN-5 (compound 5) is a proteasome inhibitor[1].

  • CAS Number: 1613134-34-1
  • MF: C20H30BN5O7
  • MW: 463.29
  • Catalog: Proteasome
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

FM19G11

FM19G11 is a hypoxia-inducible factor-1-alpha (HIF-1α) inhibitor, and it inhibits hypoxia-induced luciferase activity with an IC50 of 80 nM in HeLa cells. FM19G11 modulates other signaling pathways, including mTOR and PI3K/Akt/eNOS, when the HIF-1α pathway is inactivated under normoxic conditions[1][2].

  • CAS Number: 329932-55-0
  • MF: C23H17N3O8
  • MW: 463.39600
  • Catalog: HIF/HIF Prolyl-Hydroxylase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MSU-42011

MSU-42011 is an orally active retinoid X receptor (RXR) agonist. MSU-42011 inhibits the expression of iNOS and p-ERK protein. MSU-42011 has immunomodulatory and antitumor activity. MSU-42011 can be used for cancer research[1].

  • CAS Number: 2456434-36-7
  • MF: C24H34N2O2
  • MW: 382.54
  • Catalog: PERK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

NAMPT inhibitor-linker 1

NAMPT inhibitor-linker 1 is a drug-linker conjugates for ADC, composed of an NAMPT inhibitor as a payload, and a linker. ADC-3 consists of an NAMPT inhibitor-linker 1 and an anti-c-Kit monoclonal antibody, exihibits potent activity against c-Kit expressing cell lines such as GIST-T1 and NCI-H526 cells, with IC50s of <3 pM and 9 pM, respectively.

  • CAS Number: 2241019-57-6
  • MF: C36H37FN6O6
  • MW: 668.71
  • Catalog: Drug-Linker Conjugates for ADC
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

4-Aminobenzamidine dihydrochloride

4-Aminobenzamidine (p-Aminobenzamidine) dihydrochloride is a strong trypsin inhibitor, also acting as a relatively weak urokinase type plasminogen activator (uPA) inhibitor (Ki=82 μM). 4-Aminobenzamidine can inhibit growth of a human prostate tumor in SCID mice[1][2].

  • CAS Number: 2498-50-2
  • MF: C7H11Cl2N3
  • MW: 208.088
  • Catalog: Ser/Thr Protease
  • Density: 1.26g/cm3
  • Boiling Point: 289.8ºC at 760 mmHg
  • Melting Point: >300 °C(lit.)
  • Flash Point: 129ºC

Doxofylline

Doxofylline is an antagonist of adenosine A1 receptor which also inhibits phosphodiesterase IV.

  • CAS Number: 69975-86-6
  • MF: C11H14N4O4
  • MW: 266.253
  • Catalog: Adenosine Receptor
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 505.2±53.0 °C at 760 mmHg
  • Melting Point: 144-146ºC
  • Flash Point: 259.3±30.9 °C

IDO1-IN-20

Hy-146215 is an enzyme that catalyzes the oxidative metabolism of tryptophan. It can immunosuppress tumors in the tumor microenvironment.

  • CAS Number: 2415246-15-8
  • MF: C15H19BrFN7O4S
  • MW: 492.32
  • Catalog: Indoleamine 2,3-Dioxygenase (IDO)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Quizalofop-P

Quizalofop-P is absorbed through weed stems and leaves, conducts upward and downward in plants, accumulates at the top and intermediate meristems, inhibits cellular fatty acid synthesis, and makes weeds necrotic. Quizalofop-P is highly selective between grass weeds and dicotyledonous crops[1].

  • CAS Number: 94051-08-8
  • MF: C17H13ClN2O4
  • MW: 344.749
  • Catalog: Acetyl-CoA Carboxylase
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 533.3±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 276.3±30.1 °C

Lp-PLA2-IN-3

Lp-PLA2-IN-3 is a potent and orally bioavailable lipoprotein-associated phospholipase A2 (Lp-PLA2) inhibitor, with an IC50 of 14 nM for recombinant human Lp-PLA2 (rhLpPLA2)[1].

  • CAS Number: 2196245-16-4
  • MF: C20H13ClF3N3O3S
  • MW: 467.85
  • Catalog: Phospholipase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

4-Diethylaminobenzaldehyde

4-Diethylaminobenzaldehyde is a reversible aldehyde dehydrogenases (ALDHs) inhibitor, with a Ki of 4 nM for ALDH1. 4-Diethylaminobenzaldehyde displays potent anti-androgenic effect (IC50= 1.71μM)[1][2].

  • CAS Number: 120-21-8
  • MF: C11H15NO
  • MW: 177.243
  • Catalog: Aldehyde Dehydrogenase (ALDH)
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 329.6±0.0 °C at 760 mmHg
  • Melting Point: 37-41 °C(lit.)
  • Flash Point: 110.2±12.0 °C

Bempedoic acid-d5

Bempedoic acid-d5 is the deuterium labeled Bempedoic acid[1]. Bempedoic acid (ETC-1002) is an ATP-citrate lyase (ACL) inhibitor[1]. Bempedoic acid (ETC-1002) activates AMPK[2].

  • CAS Number: 2408131-71-3
  • MF: C19H31D5O5
  • MW: 349.52
  • Catalog: AMPK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Caffeic acid-pYEEIE TFA

PR-39, a natural proline- and arginine-rich antibacterial peptide, is a noncompetitive, reversible and allosteric proteasome inhibitor. PR-39 reversibly binds to the α7 subunit of the proteasome and blocks degradation of NF-κB inhibitor IκBα by the ubiquitin-proteasome pathway. PR-39 stimulates angiogenesis, inhibits inflammatory responses and significant reduces myocardial infarct size in mice[1][2].

  • CAS Number: 139637-11-9
  • MF: C229H345N70O40
  • MW: 4720.627
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Salubrinal

Salubrinal is a cell-permeable and selective inhibitor of eIF2α dephosphorylation.

  • CAS Number: 405060-95-9
  • MF: C21H17Cl3N4OS
  • MW: 479.810
  • Catalog: Autophagy
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A