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.


Anti-infection >
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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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Indirubin-3'-monoxime

Indirubin-3'-monoxime is a potent GSK-3β inhibitor, and weakly inhibits 5-Lipoxygenase, with IC50s of 22 nM and 7.8-10 µM, respectively; Indirubin-3'-monoxime also shows inhibitory activities against CDK5/p25 and CDK1/cyclin B, with IC50s of 100 and 180 nM.

  • CAS Number: 160807-49-8
  • MF: C16H11N3O2
  • MW: 277.277
  • Catalog: 5-Lipoxygenase
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 532.2±50.0 °C at 760 mmHg
  • Melting Point: 241 °C
  • Flash Point: 275.7±30.1 °C

Manumycin A

Manumycin A is an antibiotic. Manumycin A acts as a selective, competitive inhibitor of protein farnesyltransferase (FTase) with respect to farnesylpyrophosphate (Ki =1.2 μM), and as a noncompetitive inhibitor with respect to the Ras protein. Manumycin A induces apoptosis and exerts antitumor activity[1] [2][3].

  • CAS Number: 52665-74-4
  • MF: C31H38N2O7
  • MW: 550.643
  • Catalog: Apoptosis
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 863.6±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 476.1±34.3 °C

3-O-Acetyl-11-hydroxy-beta-boswellic acid

3-O-Acetyl-11-hydroxy-beta-boswellic acid is a potent 5-lipoxygenase (5-LO) inhibitor[1].

  • CAS Number: 146019-25-2
  • MF: C32H50O5
  • MW: 514.746
  • Catalog: 5-Lipoxygenase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 160-162 °C
  • Flash Point: N/A

Broussochalcone A

Broussochalcone A is an antioxidant and an inhibitor of Xanthine Oxidase (IC50=2.21 μM), with free radical scavenging activity. Broussochalcone A inhibits iron-induced lipid peroxidation and nitric oxide synthesis in lipopolysaccharide (LPS) -activated macrophages. Broussochalcone A also induces Apoptosis of human renal carcinoma cells by increasing ROS levels and activating FOXO3 signaling pathways[1][2].

  • CAS Number: 99217-68-2
  • MF: C20H20O5
  • MW: 340.37000
  • Catalog: Apoptosis
  • Density: 1.312g/cm3
  • Boiling Point: 595ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 327.7ºC

TD52

TD52, an Erlotinib (HY-50896) derivative, is an orally active, potent cancerous inhibitor of protein phosphatase 2A (CIP2A) inhibitor. TD52 mediates the apoptotic effect in triple-negative breast cancer (TNBC) cells via regulating the CIP2A/PP2A/p-Akt signalling pathway. TD52 indirectly reduced CIP2A by disturbing Elk1 binding to the CIP2A promoter. TD52 has less p-EGFR inhibition and has potent anti-cancer activity[1].

  • CAS Number: 1798328-24-1
  • MF: C24H16N4
  • MW: 360.41
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

17-GMB-APA-GA

17-GMB-APA-GA is an ADC Cytotoxin. 17-GMB-APA-GA is a potent HSP90 inhibitor and used for latent T. gondii infection research[1].

  • CAS Number: 256337-10-7
  • MF: C39H53N5O11
  • MW: 767.87
  • Catalog: ADC Cytotoxin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Androsterone

Androsterone is a metabolic product of testosterone and can activate Farnesoid X Receptor (FXR).

  • CAS Number: 53-41-8
  • MF: C19H30O2
  • MW: 290.440
  • Catalog: FXR
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 413.1±45.0 °C at 760 mmHg
  • Melting Point: 180-185ºC
  • Flash Point: 176.4±21.3 °C

SQ28603

SQ28603 is a potent and selective inhibitor of neutral endopeptidase 3.4.24.11 (NEP), an enzyme that degrades atrial natriuretic peptide (ANP).

  • CAS Number: 100845-83-8
  • MF: C13H17NO3S
  • MW: 267.34400
  • Catalog: Neprilysin
  • Density: 1.216g/cm3
  • Boiling Point: 533.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 276.3ºC

CORT 118335

CORT 118335 (Miricorilant, C118335) is a novel potent, selective, non-steroidal glucocorticoid receptor (GR) antagonist with Ki of 8 nM, shows modest affinity for MR.

  • CAS Number: 1400902-13-7
  • MF: C24H23F3N2O2
  • MW: 428.447
  • Catalog: Glucocorticoid Receptor
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BAPTA tetrasodium

BAPTA tetrasodium is a selective chelator for calcium. BAPTA tetrasodium, as calcium indicator, has high selectivity against magnesium and calcium. BAPTA tetrasodium is widely used as an intracellular buffer for investigating the effects of Ca2+ release from intracellular stores or influx via Ca2+-permeable channels in the plasma membrane. BAPTA tetrasodium can also inhibit phospholipase C activity independently of their role as Ca2+ chelators[1][2][3].

  • CAS Number: 126824-24-6
  • MF: C22H20N2Na4O10
  • MW: 564.361
  • Catalog: Phospholipase
  • Density: N/A
  • Boiling Point: 766.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 417.4ºC

Papain

Papain is a cysteine protease of the peptidase C1 family, which is used in food, pharmaceutical, textile, and cosmetic industries.

  • CAS Number: 9001-73-4
  • MF: C19H29N7O6
  • MW: 451.477
  • Catalog: Cathepsin
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: 29 °C

GW311616

GW311616 is a potent, intracellular, orally bioavailable, long duration inhibitor of human neutrophil elastase(HNE) with IC50 of 22 nM; free base form of GW311616A.IC50 value: 22 nM [1]Target: neutrophil elastaseThe HNE inhibitor GW311616A is selective over other human serine proteases (IC50 values >100 uM for trypsin, cathepsin G, and plasmin, >3 mM for chymotrypsin and tissue plasminogen activator). Acetylcholinesterase is not inhibited by GW311616A at 100 uM.GW311616A is more potent than thetrifluoromethylketone inhibitor ZD8321 (Ki=13 nM). GW311616A is orallybioavailable in rat, dog (Table 4) and hamster despite moderate to high plasmaclearance, which indicates that clearance is predominantly extrahepatic.

  • CAS Number: 198062-54-3
  • MF: C19H31N3O4S
  • MW: 397.53
  • Catalog: Elastase
  • Density: N/A
  • Boiling Point: 604.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 319.3ºC

ANTHRANILYL-ASP-PHE-ARG-LEU-PHE-ALA-PHE&

Fluorescent Substrate for Subtillsin can be used to detect the enzyme activity of subtillsin. Subtilisin is a bacterial serine protease[1][2].

  • CAS Number: 147471-56-5
  • MF: C66H80N14O18
  • MW: 1357.424
  • Catalog: Ser/Thr Protease
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

RGX-104

RGX-104 is a small-molecule LXR agonist that modulates innate immunity via transcriptional activation of the ApoE gene.

  • CAS Number: 610318-03-1
  • MF: C34H34Cl2F3NO3
  • MW: 632.54
  • Catalog: LXR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

TD-106

TD-106 is a cereblon (CRBN) modulator, which can be used for targeted protein degradation. BRD4 PROTACs with TD-106 induce BRD4 degradation[1].

  • CAS Number: 2250288-69-6
  • MF: C12H11N5O3
  • MW: 273.25
  • Catalog: E1/E2/E3 Enzyme
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Candoxatril

Candoxatril is a neutral endopeptidase (NEP) inhibitor.

  • CAS Number: 123122-55-4
  • MF: C29H41NO7
  • MW: 515.63800
  • Catalog: Neprilysin
  • Density: 1.21g/cm3
  • Boiling Point: 718.4ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 388.3ºC

Vildagliptin-d3

Vildagliptin-d3 (LAF237-d3) is the deuterium labeled Vildagliptin. Vildagliptin (LAF237) is a potent, stable, selective dipeptidyl peptidase IV (DPP-IV) inhibitor with an IC50 of 3.5 nM in human Caco-2 cells. Vildagliptin possesses excellent oral bioavailability and potent antihyperglycemic activity[1][2].

  • CAS Number: 1217546-82-1
  • MF: C17H22D3N3O2
  • MW: 306.41800
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Malonganenone A

Malonganenone A is a selective plasmodial Hsp70s modulator. It also has antimalarial activity.

  • CAS Number: 882403-69-2
  • MF: C26H38N4O2
  • MW: 438.61
  • Catalog: HSP
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CB2R/FAAH modulator-2

CB2R/FAAH modulator-2 (compound 26) is a dual targeting modulator that acts as a CB2R agonist and FAAH inhibitor. The Ki values for CB2R/FAAH modulator-2 are 10.8 and 152.9 nM for CB2R and CB1R, respectively, and the IC50 value for FAAH is 6.2 μM. CB2R/FAAH modulator-2 can be used in studies related to cancer, deleterious inflammatory cascades occurring in neurodegenerative diseases, and COVID-19 infection[1].

  • CAS Number: 2876918-68-0
  • MF: C24H33NO2
  • MW: 367.52
  • Catalog: Cannabinoid Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Prunin

Prunin is a potent inhibitor of human enterovirus A71 (HEVA71). Prunin shows strong inhibitory activity against protein tyrosine phosphatase 1B (PTP1B), with an IC50 of 5.5 µM[1][2].

  • CAS Number: 529-55-5
  • MF: C21H22O10
  • MW: 434.393
  • Catalog: Phosphatase
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 802.4±65.0 °C at 760 mmHg
  • Melting Point: 222-224ºC
  • Flash Point: 284.6±27.8 °C

TM6089

TM6089 is a unique Prolyl Hydroxylase (PHD) inhibitor which stimulates HIF activity without iron chelation and induces angiogenesis and exerts organ protection against ischemia. Local administration of TM6089 enhances angiogenesis, and oral administration stimulates HIF activity in transgenic rats expressing a hypoxia-responsive reporter vector[1].

  • CAS Number: 863421-32-3
  • MF: C13H14N4O3S
  • MW: 306.34
  • Catalog: HIF/HIF Prolyl-Hydroxylase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Paltimatrectinib

Paltimatrectinib (compound I-147) is a potent tyrosine kinase inhibitor with an IC50 of <10 nM for tropomyosin kinases A (TrkA). Paltimatrectinib has the potential for cancer and inflammatory diseases[1].

  • CAS Number: 2353522-15-1
  • MF: C20H15F5N6
  • MW: 434.37
  • Catalog: Tyrosinase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

FXIa-IN-6

FXIa-IN-6 is a potent FXIa inhibitor with selectivity against most of the relevant serine proteases (Ki = 0.3 nM).

  • CAS Number: 1551459-37-0
  • MF: C31H29ClF2N4O4
  • MW: 595.04
  • Catalog: Factor Xa
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SI-113

SI-113(SI113;SI 113) is a potent, specific inhibitor of the SGK1 kinase activity, induces autophagy, apoptosis and ER stress in cancer cells; blocks insulin-dependent phosphorylation of the Sgk1 substrate Mdm2, and induces necrosis and apoptosis in RKO cells; potentiates the effects of paclitaxel on cell viability; active in vivo.

  • CAS Number: 1392816-46-4
  • MF: C23H24N6O
  • MW: 400.486
  • Catalog: SGK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

KW-2478

KW-2478 is an inhibitor of Hsp90α, with an IC50 of 3.8 nM, and has antitumor activity against various human hematological tumor cells.

  • CAS Number: 819812-04-9
  • MF: C30H42N2O9
  • MW: 574.662
  • Catalog: HSP
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 746.9±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 405.5±32.9 °C

5,7-Diacetoxy-8-methoxyflavone

5,7-Diacetoxy-8-methoxyflavone is a natural product that could come from scutellaria genus plants. 5,7-Diacetoxy-8-methoxyflavone has inhibitory activity for cAMP phosphodiesterase[1].

  • CAS Number: 23246-80-2
  • MF: C20H16O7
  • MW: 368.337
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 540.9±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 238.3±30.2 °C

Methysticin

Methysticin is a major kavalactone in kava extract to induce CYP1A1.

  • CAS Number: 20697-20-5
  • MF: C15H14O5
  • MW: 274.269
  • Catalog: Cytochrome P450
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 496.5±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 223.9±28.8 °C

SPCK

MeOSuc-AAPV-CMK (Elastase Inhibitor III) is an elastase inhibitor. MeOSuc-AAPV-CMK also inhibits cathepsin G and proteinase 3.MeOSuc-AAPV-CMK blocks the cleavage of adiponectin by leukocyte elastase[1].

  • CAS Number: 65144-34-5
  • MF: C22H35ClN4O7
  • MW: 502.98900
  • Catalog: Cathepsin
  • Density: 1.234g/cm3
  • Boiling Point: 809.4ºC at 760 mmHg
  • Melting Point: 159-161ºC
  • Flash Point: 443.3ºC

SCH 42495

SCH 42495 is an orally active neutral metalloendopeptidase (NEP) inhibitor with antihypertensive effect. SCH 42495 is the orally active ethylester prodrug of SCH 42354[1].

  • CAS Number: 136511-43-8
  • MF: C20H29NO4S2
  • MW: 411.57900
  • Catalog: Neprilysin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

p53-MDM2-IN-1

p53-MDM2-IN-1 (Example 30) is an inhibitor of p53-MDM2/X protein interaction with an Ki value of 23.35 µM. p53-MDM2-IN-1 can be used for anti-tumor research[1].

  • CAS Number: 381717-91-5
  • MF: C23H20ClN3O3
  • MW: 421.88
  • Catalog: MDM-2/p53
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 686.1±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 368.7±31.5 °C