Metabolic diseases is defined by a constellation of interconnected physiological, biochemical, clinical, and metabolic factors that directly increases the risk of cardiovascular disease, type 2 diabetes mellitus, and all cause mortality. Associated conditions include hyperuricemia, fatty liver (especially in concurrent obesity) progressing to nonalcoholic fatty liver disease, polycystic ovarian syndrome (in women), erectile dysfunction (in men), and acanthosis nigricans. Metabolic disease modeling is an essential component of biomedical research and a mandatory prerequisite for the treatment of human disease. Somatic genome editing using CRISPR/Cas9 might be used to establish novel metabolic disease models.


Anti-infection >
Arenavirus Bacterial CMV Enterovirus Filovirus Fungal HBV HCV HIV HSV Influenza Virus Parasite Reverse Transcriptase RSV SARS-CoV
Antibody-drug Conjugate >
ADC Cytotoxin ADC Linker Drug-Linker Conjugates for ADC PROTAC-linker Conjugate for PAC
Apoptosis >
Apoptosis Bcl-2 Family c-Myc Caspase DAPK Ferroptosis IAP MDM-2/p53 PKD RIP kinase Survivin Thymidylate Synthase TNF Receptor
Autophagy >
Autophagy LRRK2 ULK Mitophagy
Cell Cycle/DNA Damage >
Antifolate APC ATM/ATR Aurora Kinase Casein Kinase CDK Checkpoint Kinase (Chk) CRISPR/Cas9 Deubiquitinase DNA Alkylator/Crosslinker DNA-PK DNA/RNA Synthesis Eukaryotic Initiation Factor (eIF) G-quadruplex Haspin Kinase HDAC HSP IRE1 Kinesin LIM Kinase (LIMK) Microtubule/Tubulin Mps1 Nucleoside Antimetabolite/Analog p97 PAK PARP PERK Polo-like Kinase (PLK) PPAR RAD51 ROCK Sirtuin SRPK Telomerase TOPK Topoisomerase Wee1
Cytoskeleton >
Arp2/3 Complex Dynamin Gap Junction Protein Integrin Kinesin Microtubule/Tubulin Mps1 Myosin PAK
Epigenetics >
AMPK Aurora Kinase DNA Methyltransferase Epigenetic Reader Domain HDAC Histone Acetyltransferase Histone Demethylase Histone Methyltransferase JAK MicroRNA PARP PKC Sirtuin Protein Arginine Deiminase
GPCR/G Protein >
5-HT Receptor Adenosine Receptor Adenylate Cyclase Adiponectin Receptor Adrenergic Receptor Angiotensin Receptor Bombesin Receptor Bradykinin Receptor Cannabinoid Receptor CaSR CCR CGRP Receptor Cholecystokinin Receptor CRFR CXCR Dopamine Receptor EBI2/GPR183 Endothelin Receptor GHSR Glucagon Receptor Glucocorticoid Receptor GNRH Receptor GPCR19 GPR109A GPR119 GPR120 GPR139 GPR40 GPR55 GPR84 Guanylate Cyclase Histamine Receptor Imidazoline Receptor Leukotriene Receptor LPL Receptor mAChR MCHR1 (GPR24) Melatonin Receptor mGluR Motilin Receptor Neurokinin Receptor Neuropeptide Y Receptor Neurotensin Receptor Opioid Receptor Orexin Receptor (OX Receptor) Oxytocin Receptor P2Y Receptor Prostaglandin Receptor Protease-Activated Receptor (PAR) Ras RGS Protein Sigma Receptor Somatostatin Receptor TSH Receptor Urotensin Receptor Vasopressin Receptor Melanocortin Receptor
Immunology/Inflammation >
Aryl Hydrocarbon Receptor CCR Complement System COX CXCR FLAP Histamine Receptor IFNAR Interleukin Related IRAK MyD88 NO Synthase NOD-like Receptor (NLR) PD-1/PD-L1 PGE synthase Salt-inducible Kinase (SIK) SPHK STING Thrombopoietin Receptor Toll-like Receptor (TLR) Arginase
JAK/STAT Signaling >
EGFR JAK Pim STAT
MAPK/ERK Pathway >
ERK JNK KLF MAP3K MAP4K MAPKAPK2 (MK2) MEK Mixed Lineage Kinase MNK p38 MAPK Raf Ribosomal S6 Kinase (RSK)
Membrane Transporter/Ion Channel >
ATP Synthase BCRP Calcium Channel CFTR Chloride Channel CRAC Channel CRM1 EAAT2 GABA Receptor GlyT HCN Channel iGluR Monoamine Transporter Monocarboxylate Transporter Na+/Ca2+ Exchanger Na+/HCO3- Cotransporter Na+/K+ ATPase nAChR NKCC P-glycoprotein P2X Receptor Potassium Channel Proton Pump SGLT Sodium Channel TRP Channel URAT1
Metabolic Enzyme/Protease >
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
Neuronal Signaling >
5-HT Receptor AChE Adenosine Kinase Amyloid-β Beta-secretase CaMK CGRP Receptor COMT Dopamine Receptor Dopamine Transporter FAAH GABA Receptor GlyT iGluR Imidazoline Receptor mAChR Melatonin Receptor Monoamine Oxidase nAChR Neurokinin Receptor Opioid Receptor Serotonin Transporter γ-secretase
NF-κB >
NF-κB IKK Keap1-Nrf2 MALT1
PI3K/Akt/mTOR >
Akt AMPK ATM/ATR DNA-PK GSK-3 MELK mTOR PDK-1 PI3K PI4K PIKfyve PTEN
PROTAC >
PROTAC E3 Ligase Ligand-Linker Conjugate Ligand for E3 Ligase PROTAC Linker PROTAC-linker Conjugate for PAC
Protein Tyrosine Kinase/RTK >
Ack1 ALK Bcr-Abl BMX Kinase Btk c-Fms c-Kit c-Met/HGFR Discoidin Domain Receptor DYRK EGFR Ephrin Receptor FAK FGFR FLT3 IGF-1R Insulin Receptor IRAK Itk PDGFR PKA Pyk2 ROS Src Syk TAM Receptor Trk Receptor VEGFR
Stem Cell/Wnt >
Casein Kinase ERK Gli GSK-3 Hedgehog Hippo (MST) JAK Notch Oct3/4 PKA Porcupine ROCK sFRP-1 Smo STAT TGF-beta/Smad Wnt YAP β-catenin γ-secretase
TGF-beta/Smad >
TGF-beta/Smad PKC ROCK TGF-β Receptor
Vitamin D Related >
VD/VDR
Others >
Androgen Receptor Aromatase Estrogen Receptor/ERR Progesterone Receptor Thyroid Hormone Receptor Others

Chenodeoxycholic acid

Chenodeoxycholic Acid is a hydrophobic primary bile acid that activates nuclear receptors (FXR) involved in cholesterol metabolism.

  • CAS Number: 474-25-9
  • MF: C24H40O4
  • MW: 392.572
  • Catalog: FXR
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 547.1±25.0 °C at 760 mmHg
  • Melting Point: 165-167 °C(lit.)
  • Flash Point: 298.8±19.7 °C

AS1949490

AS1949490 is a potent and selective SHIP-2 (SH2 domain-containing inositol 5′ phosphatase 2) inhibitor, with an IC50 of 620 nM. AS1949490 activated glucose metabolism via up-regulation of GLUT1 gene in L6 myotubes[1][2].

  • CAS Number: 1203680-76-5
  • MF: C20H18ClNO2S
  • MW: 371.88
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

URAT1 inhibitor 5

URAT1 inhibitor 5 (compound 16) is a potent URAT1 inhibitor. URAT1 inhibitor 5 can be used in research of hyperuricemia[1].

  • CAS Number: 2102670-94-8
  • MF: C18H14BrN3O2S
  • MW: 416.29
  • Catalog: URAT1
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Alfacalcidol

Alfacalcidol (1-hydroxycholecalciferol; Alpha D3; 1.alpha.-Hydroxyvitamin D3) is a non-selective VDR activator medication. IC50 value: Target: VDR activatorAlfacalcidol (1-hydroxycholecalciferol; Alpha D3; 1.alpha.-Hydroxyvitamin D3) improves mechanical bone strength and bone mass; suppresses osteoclastic bone resorption in vivo.

  • CAS Number: 41294-56-8
  • MF: C27H44O2
  • MW: 400.637
  • Catalog: VD/VDR
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 531.5±50.0 °C at 760 mmHg
  • Melting Point: 134-136°C
  • Flash Point: 222.6±24.7 °C

Erythrodiol

Erythrodiol is an olive oil component. Erythrodiol promotes Cholesterol efflux (ChE) by selectively inhibiting the degradation of ABCA1 protein. Erythrodiol is a good candidate to be further explored for therapeutic or preventive application in the context of atherosclerosis[1].

  • CAS Number: 545-48-2
  • MF: C30H50O2
  • MW: 442.717
  • Catalog: Metabolic Disease
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 520.5±50.0 °C at 760 mmHg
  • Melting Point: 230-231ºC(lit.)
  • Flash Point: 209.9±24.7 °C

2,8-Dihydroxyadenine

2,8-Dihydroxyadenine, an endogenous metabolite, can cause the formation of urinary crystals and kidney stones. 2,8-Dihydroxyadenine can be used to diagnose adenine phosphoribosyltransferase (APRT) deficiency[1][2].

  • CAS Number: 30377-37-8
  • MF: C5H5N5O2
  • MW: 167.13
  • Catalog: Metabolic Disease
  • Density: 2.52g/cm3
  • Boiling Point: 852.7ºC at 760mmHg
  • Melting Point: >300 °C (dec.) (lit.)
  • Flash Point: 469.5ºC

Mastoparan trifluoroacetate salt

Mastoparan, a tetradecapeptide which is a component of wasp venom, stimulates release of prolactin from cultured rat anterior pituitary cells.

  • CAS Number: 72093-21-1
  • MF: C70H131N19O15
  • MW: 1478.91000
  • Catalog: Peptides
  • Density: 1.15g/cm3
  • Boiling Point: 1676.8ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 967.9ºC

GSK-3β inhibitor 14

GSK-3β inhibitor 14 (Compound 6i), benzothiazepinone derivative, is a weak GSK-3β inhibitor (IC50 >100 μM)[1].

  • CAS Number: 863004-48-2
  • MF: C17H17NOS
  • MW: 283.39
  • Catalog: GSK-3
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Relzomostat

Relzomostat is a methionine aminopeptidase 2 (MetAP2) inhibitor.Relzomostat may be useful for the research of obesity, type 2 diabetes, and other obesity-associated conditions[1].

  • CAS Number: 2081078-92-2
  • MF: C24H36F2N2O5
  • MW: 470.55
  • Catalog: Metabolic Disease
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 535.4±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 277.6±30.1 °C

D-VAL-PHE-LYS CHLOROMETHYL KETONE, DIHYDROCHLORIDE

D-Val-Phe-Lys-CMK (D-Val-Phe-Lys Chloromethyl ketone) 可抑制纤溶酶活性。

  • CAS Number: 75590-17-9
  • MF: C21H33ClN4O3
  • MW: 424.96500
  • Catalog: Metabolic Disease
  • Density: 1.16g/cm3
  • Boiling Point: 619.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 328.5ºC

1,5-Anhydro-D-mannitol

1,5-Anhydro-D-mannitol is the inactive analogue of 1,5-Anhydrosorbitol (HY-113075), and can be used as an experimental control. 1,5-Anhydrosorbitol is a short-term marker for glycemic control.

  • CAS Number: 492-93-3
  • MF: C6H12O5
  • MW: 164.16
  • Catalog: Metabolic Disease
  • Density: 1.533g/cm3
  • Boiling Point: 376.8ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 181.7ºC

Palmatine hydroxide

Palmatine hydroxide is an orally active and irreversible indoleamine 2,3-dioxygenase 1 (IDO-1) inhibitor with IC50s of 3 μM and 157μM against HEK 293-hIDO-1 and rhIDO-1, respectively. Palmatine hydroxide can also inhibit West Nile virus (WNV) NS2B-NS3 protease in an uncompetitive manner with an IC50 of 96 μM. Palmatine hydroxide shows anti-cancer, anti-oxidation, anti-inflammatory, neuroprotection, antibacterial, anti-viral activities[1][2][3][4][5].

  • CAS Number: 131-04-4
  • MF: C21H23NO5
  • MW: 369.41100
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Glycolic acid oxidase inhibitor 1

Glycolic acid oxidase inhibitor 1 is a glycolate oxidase inhibitor, extracted from patent EP0021228A1, in Table IV.

  • CAS Number: 77529-42-1
  • MF: C16H10BrNO3
  • MW: 344.16000
  • Catalog: Metabolic Disease
  • Density: 1.641g/cm3
  • Boiling Point: 528.9ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 273.7ºC

GNE-617

GNE-617 is a specific NAMPT inhibitor that inhibits the biochemical activity of NAMPT with an IC50 of 5 nM and exhibits efficacy in xenograft models of cancer.

  • CAS Number: 1362154-70-8
  • MF: C21H15F2N3O3S
  • MW: 427.42400
  • Catalog: Nampt
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

1,2-Dilauroyl-sn-glycero-3-phosphocholine

1,2-Dilauroyl-sn-glycero-3-phosphocholine (DLPC) is an LRH-1 agonist ligand.1,2-Dilauroyl-sn-glycero-3-phosphocholine is a phospholipid for biological study[1][2].

  • CAS Number: 18194-25-7
  • MF: C32H64NO8P
  • MW: 621.83
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

KN-62

KN-62 is a selective and potent inhibitor of calmodulin-dependent protein kinase II (CaMK-II) with IC50 of 0.9 μM, KN-62 also displays noncompetitive antagonism at P2X7 receptors in HEK293 cells, with an IC50 value of approximately 15 nM.

  • CAS Number: 127191-97-3
  • MF: C38H35N5O6S2
  • MW: 721.844
  • Catalog: P2X Receptor
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 964.7±75.0 °C at 760 mmHg
  • Melting Point: 92-94°C
  • Flash Point: 537.3±37.1 °C

2-Hydroxyoctanoic acid

2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1].

  • CAS Number: 617-73-2
  • MF: C8H16O3
  • MW: 160.21
  • Catalog: Metabolic Disease
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 289.0±13.0 °C at 760 mmHg
  • Melting Point: 66-68 °C
  • Flash Point: 142.8±16.3 °C

D-ribo-Hexose,2,6-dideoxy

Digitoxose (D-(+)-Digitoxose), a natural product, specifically and competitively inhibits glucose-stimulated insulin release from islets in lean and obese mice. Digitoxose can be used in diabetes research[1].

  • CAS Number: 527-52-6
  • MF: C6H12O4
  • MW: 148.16
  • Catalog: Bacterial
  • Density: 1.366g/cm3
  • Boiling Point: 320.1ºC at 760mmHg
  • Melting Point: 98-100 °C
  • Flash Point: 147.4ºC

Xanthine oxidase-IN-7

Xanthine oxidase-IN-7 (compound1h) is a potent andorally active XO (xanthine oxidase) inhibitor with an IC50 of 0.36 µM. Xanthine oxidase-IN-7 effectively reduces serum uric acid levels. Xanthine oxidase-IN-7 has the potential for the research of hyperuricemia and gout[1].

  • CAS Number: 2411698-59-2
  • MF: C16H14N4O2
  • MW: 294.31
  • Catalog: Xanthine Oxidase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(13R,14R)-14,19-Dihydro-12,13-dihydroxy-20-norcrotalanan-11,15-dione 4-oxide

Monocrotaline N-Oxide, a monocrotaline metabolite, leads to DNA adduct formation in vivo[1].

  • CAS Number: 35337-98-5
  • MF: C16H23NO7
  • MW: 341.35600
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ppc-1

Ppc-1 is a mitochondrial uncoupler. Ppc-1 enhances mitochondrial oxygen consumption without adverse effects on ATP production. Ppc-1 is a cell-permeate interleukin-2 (IL-2) inhibitor. Ppc-1 inhibits the Gram-negative periodontopathogen Porphyromonas gingivalis. Ppc-1 has anti-obesity, antibacterial and anti-inflammatory activities[1][2][3][4].

  • CAS Number: 1245818-17-0
  • MF: C21H25NO4
  • MW: 355.43
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(R)-(-)-2-Butanol

(R)-(-)-2-Butanol is released by the females of the white grub beetle, Dasylepida ishigakiensis, to attract males. (R)-(-)-2-Butanol is an intermediate of pharmaceutical synthesis by coupling[1][2].

  • CAS Number: 14898-79-4
  • MF: C4H10O
  • MW: 147.172
  • Catalog: Metabolic Disease
  • Density: 0.807
  • Boiling Point: 99-100ºC
  • Melting Point: -114ºC
  • Flash Point: 26ºC

2-ethyl-2-hydroxybutyric acid

2-Ethyl-2-hydroxybutanoic acid (2-Ethyl-2-hydroxybutyric acid) is a hydroxy fatty acid. 2-Ethyl-2-hydroxybutanoic is a metabolite of DEHP (HY-B1945)[1].

  • CAS Number: 3639-21-2
  • MF: C6H12O3
  • MW: 132.15800
  • Catalog: Metabolic Disease
  • Density: 1.103g/cm3
  • Boiling Point: 251.3ºC at 760mmHg
  • Melting Point: 78-82ºC
  • Flash Point: 120.1ºC

Oroxin A

Oroxin A is the major component of an ethanol-water Oroxylum indicum (L.) Kurz (Bignoniaceae) seed extract (OISE), activates peroxisome proliferator-activated receptor γ (PPARγ) by docking into the PPARγ protein ligand-binding domain. Oroxin A exhibits an inhibitory activity against α-glucosidase and an antioxidant capacity[1]. Oroxin A exerts anti-breast cancer effects by inducing ER stress-mediated senescence[2].

  • CAS Number: 57396-78-8
  • MF: C21H20O10
  • MW: 432.378
  • Catalog: PARP
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 784.0±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 279.0±26.4 °C

NNC 0640

NNC-0640 is a potent human G-protein-coupled glucagon receptor (GCGR) negative allosteric modulator (NAM) with an IC50 of 69.2 nM[1].

  • CAS Number: 307986-98-7
  • MF: C29H31N7O4S
  • MW: 573.67
  • Catalog: Glucagon Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

α-Glucosidase-IN-21

α-Glucosidase-IN-21 (Compound 2B) is a potent, orally active α-glucosidase inhibitor with an IC50 of 2.62 μM. α-Glucosidase-IN-21 shows anti-diabetic activity[1].

  • CAS Number: 321686-01-5
  • MF: C24H23NO2S
  • MW: 389.51
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Mogroside IVa

Mogroside IV-A, a triterpenoid glycoside isolated from the extracts of Luo Han Guo, is a nonsugar sweetener. Mogrosides are sweeter than sucrose. Mogrosides exhibit antioxidant, antidiabetic and anticancer activities[1].

  • CAS Number: 88901-41-1
  • MF: C54H92O24
  • MW: 1125.294
  • Catalog: Cancer
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 1177.2±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 665.7±34.3 °C

NAAD sodium salt

NAAD sodium salt (Deamido nad sodium salt), a functional NAD+ precursor, is the substrate of glutamine-dependent NAD+ synthetase. NAAD sodium salt is used to study the structure of nicotinate mononucleotide adenylyltransferases[1][2].

  • CAS Number: 104809-30-5
  • MF: C21H25N6NaO15P2
  • MW: 686.39
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(RS)-APICA

APICA is a potent CB1 and CB2 receptors agonist with EC50 values of 118 nM and 37 nM against CB1 and CB2 receptors, respectively. APICA possess cannabimimetic activity in vivo[1].

  • CAS Number: 170847-18-4
  • MF: C10H12NO5P
  • MW: 257.18
  • Catalog: Cannabinoid Receptor
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 559.9±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 292.4±32.9 °C

DPP IV/hCA II-IN-1

DPP IV/hCA II-IN-1 is a potent and selective dipeptidyl peptidase IV (DPP IV) and carbonic anhydrase (CA) inhibitor with an IC50 value of 0.049 μM for DPP IV and with Ki values of 0.0361, 0.0428, 0.0941, 0.1328, 0.2615, and 3.034 μM for CA II, CA VB, CA VA, CA IX, CA I, and CA IV, respectively[1].

  • CAS Number: 2836996-95-1
  • MF: C17H20N2O5S
  • MW: 364.42
  • Catalog: Carbonic Anhydrase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A