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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Tris(2,4-di-tert-butylphenyl)phosphate

Tris(2,4-di-tert-butylphenyl)phosphate is an active compound from the leaves of Vitex negundo L. shows anti-inflammatory activity with evidence of inhibition for secretory Phospholipase A2 (sPLA2) through molecular docking[1].

  • CAS Number: 95906-11-9
  • MF: C42H63O4P
  • MW: 662.92100
  • Catalog: Phospholipase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 99-101 °C(lit.)
  • Flash Point: N/A

Phenethyl ferulate

Phenethyl ferulate is a major constituent ofQianghuo, shows inhibitory activity against cyclooxygenase (COX) and 5-lipoxygenase (5-LOX) with IC50 values of 4.35 μM and 5.75 μM, respectively[1].

  • CAS Number: 71835-85-3
  • MF: C18H18O4
  • MW: 298.33
  • Catalog: COX
  • Density: 1.193g/cm3
  • Boiling Point: 474.7ºC at 760 mmHg
  • Melting Point: 81℃
  • Flash Point: 171.6ºC

TCS 401

TCS 401 is a selective inhibitor of protein tyrosine phosphatase 1B (PTP1B).

  • CAS Number: 243966-09-8
  • MF: C10H11ClN2O5S
  • MW: 306.723
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SA 57

SA57 is a potent, selective FAAH inhibitor with IC50s of 3.2 nM and 1.9 nM for mouse and human FAAH. SA57 also inhibits the 2-arachidonoylglycerol hydrolases MAGL (IC50s of 410 nM and 1.4 μM for mouse and human MAGL) and mouse α/β-hydrolase domain-containing protein 6 (mABHD6; IC50 of 850 nM), but not other brain serine hydrolases[1][2].

  • CAS Number: 1346169-63-8
  • MF: C17H23ClN2O3
  • MW: 338.829
  • Catalog: FAAH
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 512.1±30.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 263.5±24.6 °C

PD 113413

PD 113413 is formed by subsequent hydrolysis of the diketopiperazine quinapril analog. PD 113413 is a potent angiotensin-converting enzyme inhibitor. PD 113413 can be used for research of hypertension and congestive heart failure[1].

  • CAS Number: 103733-50-2
  • MF: C23H24N2O4
  • MW: 392.45
  • Catalog: Angiotensin-converting Enzyme (ACE)
  • Density: 1.33g/cm3
  • Boiling Point: 669.8ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 358.9ºC

Lodelaben

Lodelaben is a human neutrophil elastase inhibitor with an IC50 and Ki of 0.5 and 1.5 μM, respectively.

  • CAS Number: 111149-90-7
  • MF: C25H41ClO3
  • MW: 425.04400
  • Catalog: Elastase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

PDEδ-IN-99

PDEδ-IN-99 is a novel potent K-Ras-PDEδ inhibitor that binds to the farnesyl binding pocket of PDEδ with Kd of 8±4 nM.

  • CAS Number: 1841464-21-8
  • MF: C25H26FN5O2
  • MW: 447.514
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cornoside

Cornoside is a phenolic glycoside and has inhibitory effect on rat lens aldose reductase (AR) with an IC50 of 150 μM[1].

  • CAS Number: 40661-45-8
  • MF: C14H20O8
  • MW: 316.30400
  • Catalog: Aldose Reductase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

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

9-cis-Retinoic acid-d5

9-cis-Retinoic acid-d5 (ALRT1057-d5) is the deuterium labeled 9-cis-Retinoic acid. 9-cis-Retinoic acid (ALRT1057), a vitamin A derivative, is a potent RAR/RXR agonist. 9-cis-Retinoic acid induces apoptosis, regulates cell cycle and has anticancer, anti-inflammatory and neuroprotection activities[1][2][3][4][5][6].

  • CAS Number: 78996-15-3
  • MF: C20H23D5O2
  • MW: 305.47
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Enazadrem

Enazadrem is a 5-lipoxygenase inhibitor with antiinflammatory activities.

  • CAS Number: 107361-33-1
  • MF: C18H25N3O
  • MW: 299.41100
  • Catalog: 5-Lipoxygenase
  • Density: 1.11g/cm3
  • Boiling Point: 492.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 251.5ºC

Opicapone

Opicapone is an available catechol-O-methyltransferase (COMT) inhibitor. Opicapone decreases the ATP content of the cells with IC50 values of 98 μM.

  • CAS Number: 923287-50-7
  • MF: C15H10Cl2N4O6
  • MW: 413.16900
  • Catalog: COMT
  • Density: 1.80±0.1 g/cm3 (20 °C, 760 mmHg)
  • Boiling Point: 701.1±70.0 °C (760 mmHg)
  • Melting Point: N/A
  • Flash Point: N/A

NUCC-0223619

NUCC-0223619 is an IDO1 inhibitor, induce degradation of IDO protein. NUCC-0223619 can be used to synthesis PROTAC[1].

  • CAS Number: 1923835-78-2
  • MF: C24H24ClFN2O2
  • MW: 426.91
  • Catalog: Indoleamine 2,3-Dioxygenase (IDO)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Omesdafexor

Omesdafexor is a FXR agonist. Omesdafexor can be used in the research of liver disease or a metabolic inflammation-mediated disease[1][2].

  • CAS Number: 2244440-85-3
  • MF: C34H43N3O3
  • MW: 541.72
  • Catalog: FXR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ranirestat

Ranirestat (AS-3201) is an aldose reductase inhibitor being developed for the treatment of diabetic neuropathy.

  • CAS Number: 147254-64-6
  • MF: C17H11BrFN3O4
  • MW: 420.18900
  • Catalog: Aldose Reductase
  • Density: 1.83g/cm3
  • Boiling Point: 702.7ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 378.8ºC

Lisinopril

Lisinopril is angiotensin-converting enzyme inhibitor, used in treatment of hypertension, congestive heart failure, and heart attacks.Target: ACELisinopril is a potent, competitive inhibitor of angiotensin-converting enzyme (ACE), the enzyme responsible for the conversion of angiotensin I (ATI) to angiotensin II (ATII). ATII regulates blood pressure and is a key component of the renin-angiotensin-aldosterone system (RAAS). Lisinopril may be used to treat hypertension and symptomatic congestive heart failure, to improve survival in certain individuals following myocardial infarction, and to prevent progression of renal disease in hypertensive patients with diabetes mellitus and microalbuminuria or overt nephropathy [1, 2].

  • CAS Number: 76547-98-3
  • MF: C21H31N3O5
  • MW: 405.488
  • Catalog: Angiotensin-converting Enzyme (ACE)
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 666.4±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 356.9±31.5 °C

PA 452

PA452, retinoic X receptor (RXR) specific antagonist, inhibits the effect of Retinoic acid (RA) on Th1/Th2 development[1].

  • CAS Number: 457657-34-0
  • MF: C26H37N3O3
  • MW: 439.59
  • Catalog: RAR/RXR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

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

Okadaic acid ammonium salt

Okadaic acid, a marine toxin, is an inhibitor of protein phosphatases (PP), including PP1 (IC50=15-50 nM), PP2A (IC50=0.1-0.3 nM), PP3 (IC50=3.7-4 nM), PP4 (IC50=0.1 nM), PP5 (IC50=3.5 nM), with a significantly higher affinity for PP2A. Okadaic acid increase of phosphorylation of a number of proteins by inhibiting PP, and acts a tumor promoter[1] [2].

  • CAS Number: 155716-06-6
  • MF: C44H71NO13
  • MW: 822.03
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: 947.3ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 526.7ºC

Nutlin-3

(Rac)-Nutlin-3 (Rebemadlin), an active enantiomer of Nutlin-3, is a potent murine double minute (MDM2) inhibitor (IC50=90 nM). (Rac)-Nutlin-3 inhibits MDM2-p53 interactions and stabilizes the p53 protein, and induces cell autophagy and apoptosis. (Rac)-Nutlin-3 has the potential for the study of TP53 wild-type ovarian carcinomas[1][2].

  • CAS Number: 890090-75-2
  • MF: C30H30Cl2N4O4
  • MW: 581.49
  • Catalog: Apoptosis
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

JPM-OEt

JPM-OEt is a broad spectrum cysteine cathepsin inhibitor. JPM-OEt binds covalently in the active site, and irreversibly inhibits the cysteine cathepsin family. Antitumor activity[1][2].

  • CAS Number: 262381-84-0
  • MF: C20H28N2O6
  • MW: 392.44600
  • Catalog: Cathepsin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

WES-1

WES-1 (Compound 8g) is an inhibitor of carbonic anhydrase IX (Ki: 55.9 μM). WES-1 has broad spectrum anti-proliferative activity against the cancer cells, such as leukemia (K-562 and MOLT-4), non-small cell lung cancer (NCI–H460), colon cancer (HCT 116 and HCT-15) and melanoma (LOX IMVI) cell lines[1].

  • CAS Number: 2748673-86-9
  • MF: C20H20N4O3S
  • MW: 396.46
  • Catalog: Carbonic Anhydrase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

IDO-IN-18

IDO-IN-18 (Compound 00815) is an IDO inhibitor. IDO-IN-18 can be used for research of immunosuppression associated infectious or cancer diseases[1].

  • CAS Number: 314027-92-4
  • MF: C10H8N2O2S
  • MW: 220.25
  • Catalog: Indoleamine 2,3-Dioxygenase (IDO)
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 526.6±30.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 272.3±24.6 °C

Razuprotafib

Razuprotafib is a potent protein tyrosine phosphatase β (HPTPβ) inhibitor.

  • CAS Number: 1008510-37-9
  • MF: C26H26N4O6S3
  • MW: 586.703
  • Catalog: Phosphatase
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Fosinoprilat

Fosfenopril is a potent angiotensin converting enzyme (ACE) inhibitor. Fosfenopril alleviates lipopolysaccharide (LPS)-induced inflammation by inhibiting TLR4/NF-κB signaling in monocytes[1][2].

  • CAS Number: 95399-71-6
  • MF: C23H34NO5P
  • MW: 435.49400
  • Catalog: Toll-like Receptor (TLR)
  • Density: 1.238g/cm3
  • Boiling Point: 728.9ºC at 760mmHg
  • Melting Point: >300ºC
  • Flash Point: 394.6ºC

Enterokinase

Enteropeptidase (TMPRSS15), a type II transmembrane serine protease and a physiological activator of trypsinogen. Enteropeptidase is associated with the brush border membrane (BBM) of the enterocytes in the upper small intestine. Trypsinogen is the primary substrate for Enteropeptidase. Enteropeptidase is involved in digestion in humans and animals[1].

  • CAS Number: 9014-74-8
  • MF:
  • MW:
  • Catalog: Ser/Thr Protease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Elastatinal

Elastatinal is a potent and competitive inhibitor of elastase, with a Ki of 0.21 μM. Elastatinal more potently inhibits pancreatic elastase versus leucocyte elastase. Elastatinal shows no activity on human leucocyte chymotrypsin-like protease[1][2][3][4].

  • CAS Number: 51798-45-9
  • MF: C21H36N8O7
  • MW: 512.56
  • Catalog: Elastase
  • Density: 1.44 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MMP-7-IN-3

MMP-7-IN-3 is a potent and selective inhibitor of MMP-7. MMP-7-IN-3 suppresses kidney fibrosis progression in a mouse model with unilateral ureteral obstruction[1].

  • CAS Number: 2865097-58-9
  • MF: C34H43ClF3N7O9S
  • MW: 818.26
  • Catalog: MMP
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Hu7691 free base

Hu7691 free base is an orally active, selective Akt inhibitor with IC50s of 4.0 nM, 97.5 nM, 28 nM for Akt1, Akt2 and Akt3, respectively. Hu7691 free base inhibits tumor growth and enables decrease of cutaneous toxicity in mice[1].

  • CAS Number: 2241232-43-7
  • MF: C22H21F3N4O
  • MW: 414.42
  • Catalog: ROCK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

D-Isofloridoside

D-Isofloridoside, one of the polysaccharide precursors, has the activity of scavenging free radicals, inhibiting ROS expression, and inhibiting MMP-2 and MMP-9[1][2].

  • CAS Number: 23202-76-8
  • MF: C9H18O8
  • MW: 254.23
  • Catalog: MMP
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A