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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SR1555

SR1555 is a specific retinoic acid receptor-related orphan nuclear receptor γ (RORγ) inverse agonist with an IC50 value of 1 μM. SR1555 not only inhibits TH17 cell development and function but also increases the frequency of T regulatory cells, as well as inhibits the expression of IL-17. SR1555 can be used for researching autoimmune diseases[1].

  • CAS Number: 1386439-51-5
  • MF: C22H22F6N2O2
  • MW: 460.41300
  • Catalog: ROR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

JZL195

JZL195 is a selective and efficacious dual FAAH/MAGL inhibitor with IC50 of 13 nM and 19 nM for mouse brain FAAH and MAGL respectively.IC50 value: 13 nM/19 nM (mouse brain FAAH/MAGL) [1]Target: dual FAAH/MAGL inhibitorin vitro: JZL195 shows only modest and incomplete inhibitory activity against NTE (IC50 >5 uM). At higher concentrations, JZL195 inhibited ABHD6 but not any of the other brain serine hydrolases detected in our competitive ABPP assays. JZL195 also inhibited rat and human FAAH and MAGL enzymes with IC50 values in the range of 10–100 nM based on competitive ABPP assays [1].in vivo: A time course analysis of mice given one administration ofJZL195 (20 mg/kg, i.p.) revealed that blockade of FAAH andMAGL lasted at least 10 h as judged by gel-based ABPP or AEAand 2-AG hydrolysis assays [1]. The effect of systemic injections of a range of doses of JZL195 and the pan-cannabinoid receptor agonist WIN55212 were performed 1 day following intraplantar injection of CFA in C57BL/6 mice. JZL195 and WIN55212 both reduced mechanical allodynia and thermal hyperalgesia, and produced catalepsy and sedation in a dose dependent manner. Unlike WIN55212, JZL195 reduced allodynia at doses below those at which side-effects were observed [2].

  • CAS Number: 1210004-12-8
  • MF: C24H23N3O5
  • MW: 433.457
  • Catalog: FAAH
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 581.8±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 305.7±30.1 °C

Tetramisole hydrochloride

Tetramisole hydrochloride is an inhibitor of alkaline phosphatases, is a high purity antiparasitic.

  • CAS Number: 5086-74-8
  • MF: C11H13ClN2S
  • MW: 240.752
  • Catalog: Parasite
  • Density: N/A
  • Boiling Point: 344.4ºC at 760 mmHg
  • Melting Point: 266-267ºC
  • Flash Point: 162.1ºC

Teneligliptin

Teneligliptin is a potent chemotype prolylthiazolidine-based DPP-4 inhibitor, which competitively inhibits human plasma, rat plasma, and human recombinant DPP-4 in vitro, with IC50s of approximately 1 nM.

  • CAS Number: 760937-92-6
  • MF: C22H30N6OS
  • MW: 426.578
  • Catalog: Dipeptidyl Peptidase
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 663.4±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 355.0±31.5 °C

Swertiajaponin

Swertiajaponin is a tyrosinase inhibitor, forms multiple hydrogen bonds and hydrophobic interactions with the binding pocket of tyrosinase, with an IC50 of 43.47 μM. Swertiajaponin also inhibits oxidative stress-mediated MAPK/MITF signaling, leading to decrease in tyrosinase protein level. Swertiajaponin suppresses melanin accumulation and exhibits strong anti-oxidative activity[1].

  • CAS Number: 6980-25-2
  • MF: C22H22O11
  • MW: 462.404
  • Catalog: Tyrosinase
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 761.3±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 266.6±26.4 °C

Chrysosplenetin

Chrysosplenetin is one of the polymethoxylated flavonoids in Artemisia annua L. (Compositae) and other several Chinese herbs. Chrysosplenetin inhibits P-gp activity and reverses the up-regulated P-gp and MDR1 levels induced by artemisinin (ART). Chrysosplenetin significantly augments the rat plasma level and anti-malarial efficacy of ART, partially due to the uncompetitive inhibition effect of Chrysosplenetin on rat CYP3A[1].

  • CAS Number: 603-56-5
  • MF: C19H18O8
  • MW: 374.341
  • Catalog: P-glycoprotein
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 615.8±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 222.7±25.0 °C

Ritonavir

Ritonavir is an inhibitor of HIV protease used to treat HIV infection and AIDS.

  • CAS Number: 155213-67-5
  • MF: C37H48N6O5S2
  • MW: 720.944
  • Catalog: HIV
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 947.0±65.0 °C at 760 mmHg
  • Melting Point: 120-122°C
  • Flash Point: 526.6±34.3 °C

FPFT-2216

FPFT-2216, a “molecular glue” compound, degrades phosphodiesterase 6D (PDE6D), zinc finger transcription factors Ikaros (IKZF1), Aiolos (IKZF3), and casein kinase 1α (CK1α). FPFT-2216 can be used for the research of cancer and inflammatory disease[1][2].

  • CAS Number: 2367619-87-0
  • MF: C12H12N4O3S
  • MW: 292.31
  • Catalog: Casein Kinase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SB 204990

SB 204990 is a potent and specific inhibitor of ATP citrate lyase (ACLY) enzyme.

  • CAS Number: 154566-12-8
  • MF: C18H22Cl2O5
  • MW: 389.27000
  • Catalog: ATP Citrate Lyase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

YM-53601

YM-53601, a squalene synthase inhibitor, reduces plasma cholesterol and triglyceride levels in vivo[1]. YM-53601 inhibits squalene synthase derived from human hepatoma cells with an IC50 of 79 nM. Lipid-lowering agent[2]. YM-53601 also is an inhibitor of farnesyl-diphosphate farnesyltransferase 1 (FDFT1) enzyme activity and abrogates HCV propagation[3].

  • CAS Number: 182959-33-7
  • MF: C21H22ClFN2O
  • MW: 372.86
  • Catalog: HCV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

URAT1&XO inhibitor 2

URAT1&XO inhibitor 2 (Compound BDEO) is a dual inhibitor of xanthine oxidase and URAT1, with IC50 of 3.3 μM for xanthine oxidase. URAT1&XO inhibitor 2 blocks uptake of uric acid in HEK293 cells expressing URAT1, with a Ki value of 0.145 μM. URAT1&XO inhibitor 2 decreases serum urate level and uric acid excretion in hyperuricemic mice. URAT1&XO inhibitor 2 can be used for research of hyperuricemia[1].

  • CAS Number: 1239488-96-0
  • MF: C14H12BrNO3
  • MW: 322.15
  • Catalog: URAT1
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

IDX184

IDX184 is a potent and orally bioavailable inhibitor of HCV replication. IDX184 potently inhibits HCV polymerase (IC50=0.31 μM, Ki=52.3 nM)[1][2].

  • CAS Number: 1036915-08-8
  • MF: C25H35N6O9PS
  • MW: 626.61900
  • Catalog: HCV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

RWJ-445167

RWJ-445167 is a dual inhibitor of thrombin and factor Xa with Ki of 4.0 nM and 230 nM, respectively, exhibiting potent antithrombotic activity.

  • CAS Number: 226566-43-4
  • MF: C18H24N6O5S
  • MW: 436.485
  • Catalog: Factor Xa
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Palmitic acid-d4

Palmitic acid-d4 is the deuterium 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: 75736-49-1
  • MF: C16H28D4O2
  • MW: 260.44900
  • Catalog: HSP
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2α,19α-Dihydroxy-3-oxo-urs-12-en-28-oic acid

2α,19α-Dihydroxy-3-oxo-urs-12-en-28-oic acid, a natural ursane-type triterpene, is a potent inhibitor of HIV Protease (HIV Protease). 2α,19α-Dihydroxy-3-oxo-urs-12-en-28-oic acid is also an inhibitor of the activation of Epstein-Barr virus early antigen (EBV-EA). 2α,19α-Dihydroxy-3-oxo-urs-12-en-28-oic acid displays an inhibitory activity against nitric oxide production in Lipopolysaccharide (Lipopolysaccharides)-activated RAW 264.7 cells[1][2].

  • CAS Number: 176983-21-4
  • MF: C30H46O5
  • MW: 486.683
  • Catalog: HSV
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 616.9±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 340.9±28.0 °C

Amrinone

Amrinone (Inamrinone) is a positive inotropic-vasodilator agent. Amrinone is a selective phosphodiesterase III inhibitor that increases cyclic adenosine monophosphate by preventing its breakdown. Amrinone is also an orally active, non-glycosidic and non-catecholamine cardiotonic agent[1][2][3].

  • CAS Number: 60719-84-8
  • MF: C10H9N3O
  • MW: 187.198
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 451.5±45.0 °C at 760 mmHg
  • Melting Point: 294-297ºC
  • Flash Point: 226.9±28.7 °C

Cytostatin

Cytostatin is a potent and selective inhibitor of PP2A with promising antitumor activity. Cytostatin belongs to the fostriecin family of natural products[1].

  • CAS Number: 682329-63-1
  • MF: C21H33O7P
  • MW: 428.456
  • Catalog: Phosphatase
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 645.2±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 344.0±34.3 °C

Limocitrin

Limocitrin is a natural product that can be isolated from the buds of P. acerifolia and P. orientalis. Limocitrin suppresses estradiol-dependent proliferation of MCF7 cells weakly but estradiol-induced AlkP (alkaline phosphatase) expression only marginally[1].

  • CAS Number: 489-33-8
  • MF: C17H14O8
  • MW: 346.28800
  • Catalog: Phosphatase
  • Density: 1.591g/cm3
  • Boiling Point: 621.2ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 231.4ºC

LG-100064

LG-100064 is a retinoid-X-receptor (RXR) agonist, with EC50s of 330 nM, 200 nM, and 260 nM for RXRα, RXRβ and RXRγ; LG-100064 can be used in the research of cancer.

  • CAS Number: 153559-46-7
  • MF: C23H26O3
  • MW: 350.45100
  • Catalog: RAR/RXR
  • Density: 1.095
  • Boiling Point: 491.367ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: N/A

4-Methylpyrazole hydrochloride

Fomepizole (4-Methylpyrazole) hydrochloride is a potent cytochrome P450 (CYP2E1) inhibitor. Fomepizole hydrochloride is a competitive inhibitor of the enzyme alcohol dehydrogenase. Fomepizole hydrochloride blocks further conversion of methanol and ethylene glycol to toxic metabolites. Fomepizole hydrochloride has the potential for an antidote for ethylene glycol or methanol poisoning[1][2][3].

  • CAS Number: 56010-88-9
  • MF: C4H7ClN2
  • MW: 118.56500
  • Catalog: Cytochrome P450
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 157-159 °C
  • Flash Point: N/A

SCD1-IN-1

SCD1-IN-1 is a SCD1 inhibitor (IC50: 5.8 nM). SCD1-IN-1 can be used in the research of dermatologic condition[1].

  • CAS Number: 1111078-63-7
  • MF: C20H20F3NO4
  • MW: 395.37
  • Catalog: Stearoyl-CoA Desaturase (SCD)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-ALPHA-CBZ-ARG-ARG 7-AMIDO-4-METHYLCOUMARIN HYDROCHLORIDE

Z-Arg-Arg-AMC hydrochloride is a selective substrate of cathepsin B[1].

  • CAS Number: 136132-67-7
  • MF: C30H40ClN9O6
  • MW: 658.14800
  • Catalog: Cathepsin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Schaftoside

Schaftoside is a flavonoid found in a variety of Chinese herbal medicines, such as Eleusine indica. Schaftoside inhibits the expression of TLR4 and Myd88. Schaftoside also decreases Drp1 expression and phosphorylation, and reduces mitochondrial fission[1].

  • CAS Number: 51938-32-0
  • MF: C26H28O14
  • MW: 564.49
  • Catalog: Dynamin
  • Density: 1.8±0.1 g/cm3
  • Boiling Point: 1028.2±65.0 °C at 760 mmHg
  • Melting Point: 228ºC
  • Flash Point: 342.7±27.8 °C

IDO-IN-6

IDO-IN-6 (NLG-1486) is an indoleamine 2,3-dioxygenase (IDO) inhibitor extracted from patent WO WO2012142237A1, Compound 1486, has an IC50 of <1 μM.

  • CAS Number: 1402837-76-6
  • MF: C18H21FN2O2
  • MW: 316.370
  • Catalog: Indoleamine 2,3-Dioxygenase (IDO)
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 555.4±35.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 289.7±25.9 °C

MeOSuc-Ala-Ala-Pro-Met-AMC

MeOSuc-Ala-Ala-Pro-Met-AMC is a peptide substrate of elastases and chymotrypsin-like serine peptidases[1].

  • CAS Number: 201853-55-6
  • MF: C31H41N5O9S
  • MW: 659.750
  • Catalog: Elastase
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 1033.2±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 578.6±34.3 °C

Renin Substrate 1 trifluoroacetate salt

Renin substrate 1 is a Renin substrate with high affinity to the enzyme[1].

  • CAS Number: 791068-69-4
  • MF: C109H156N32O21S
  • MW: 2282.672
  • Catalog: Renin
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Anagliptin hydrochloride

Anagliptin (SK-0403) hydrochloride is a highly selective, potent, orally active inhibitor of dipeptidyl peptidase 4 (DPP-4), with an IC50 of 3.8 nM, and less selective at DPP-8 and DDP-9 with IC50s of 68 nM and 60 nM, respectively[1].

  • CAS Number: 1359670-56-6
  • MF: C19H26ClN7O2
  • MW: 419.908
  • Catalog: Dipeptidyl Peptidase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Tubulin/MMP-IN-2

Tubulin/MMP-IN-2 is dual inhibitor of tubulin and matrix metalloproteinases. Tubulin/MMP-IN-2 can strongly inhibit tubulin polymerization and induces cell Apoptosis. Tubulin/MMP-IN-2 has inhibitory activities against MMP-2, MMP-3 and MMP-9 with IC50 values of 24.95 μM, 31.60 μM and 22.37 μM, respectively. Tubulin/MMP-IN-2 can be used for the research of cancer[1].

  • CAS Number: 2734877-51-9
  • MF: C40H48NO11P
  • MW: 749.78
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

20S Proteasome-IN-2

20S Proteasome-IN-2 is a human 20S proteasome inhibitor. 20S Proteasome-IN-2 shows high selectivity to its β5 subunit with the IC50 of 0.18 μM. 20S Proteasome-IN-2 displays anti-proliferative effect in vitro and in vivo, and arrests cell cycle at G2/M[1].

  • CAS Number: 2028300-31-2
  • MF: C30H44N4O8S
  • MW: 620.76
  • Catalog: Proteasome
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

UK 383367

UK-383367 (UK 383367) is a potent and selective inhibitor of BMP-1 (procollagen C-proteinase) with IC50 of 44 nM; Selective for BMP-1 over MMPs 1, 2, 3, 9 and 14 (IC50 values are >10,000 nM for listed MMPs).IC50 value: 44 nMTarget: procollagen C-proteinaseUK-383367 (UK 383367) is useful for anti-scarring agent

  • CAS Number: 348622-88-8
  • MF: C15H24N4O4
  • MW: 324.375
  • Catalog: Procollagen C Proteinase
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 136-138℃
  • Flash Point: N/A