Chemsrc provides Signaling Pathways's classification. They are divided into Anti-infection, Antibody-drug Conjugate, Apoptosis, Autophagy, Cell Cycle/DNA Damage, Cytoskeleton, Epigenetics, GPCR/G Protein, Immunology/Inflammation, JAK/STAT Signaling, MAPK/ERK Pathway, Membrane Transporter/Ion Channel, Metabolic Enzyme/Protease, Neuronal Signaling, NF-κB, PI3K/Akt/mTOR, PROTAC, Protein Tyrosine Kinase/RTK, Stem Cell/Wnt, TGF-beta/Smad, Vitamin D Related, Others according to their Biological activity.


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

Clomipramine-d3 (hydrochloride)

Clomipramine D3 hydrochloride is a deuterium labeled Clomipramine hydrochloride. Clomipramine hydrochloride is a serotonin transporter (SERT), norepinephrine transporter (NET) dopamine transporter (DAT) blocker with Ki of 0.14, 54 and 3 nM, respectively[1][2].

  • CAS Number: 1398065-86-5
  • MF: C19H21D3Cl2N2
  • MW: 354.332
  • Catalog: Dopamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: 9℃

Alkynyl Palmitic Acid

Alkynyl Palmitic Acid is an alkyl chain-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 99208-90-9
  • MF: C16H28O2
  • MW: 252.392
  • Catalog: PROTAC Linker
  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 371.8±15.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 180.7±15.1 °C

pimozide

Pimozide is a dopamine receptor antagonist, with Kis of 1.4 nM, 2.5 nM and 588 nM for dopamine D2, D3 and D1 receptors, respectively, and also has affinity at α1-adrenoceptor, with a Ki of 39 nM; Pimozide also inhibits STAT3 and STAT5.

  • CAS Number: 2062-78-4
  • MF: C28H29F2N3O
  • MW: 461.546
  • Catalog: Adrenergic Receptor
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 649.0±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 346.3±34.3 °C

Rilapladib

Rilapladib is a selective Lipoprotein-Associated Phospholipase A2 (Lp-PLA2) inhibitor with an IC50 of 230 pM.

  • CAS Number: 412950-08-4
  • MF: C40H38F5N3O3S
  • MW: 735.80500
  • Catalog: Phosphatase
  • Density: 1.36g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

NH2-AKA-COOH

NH2-AKA-COOH is a oligopeptide compoused of Ala-Lys-Ala.

  • CAS Number: 33062-84-9
  • MF: C12H24N4O4
  • MW: 288.34
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

WC-3035

Sarecycline is an orally effective narrow-spectrum tetracycline derivative antibiotic. Sarecycline has anti-inflammatory activity. Sarecycline inhibits the activity of Gram-positive bacteria and several types of keratobacterium acnes. Sarecycline interferes with tRNA accommodation and tethers mRNA to the 70S ribosome. Sarecycline can be used to study moderate to severe acne[1][2][3][4][5][6].

  • CAS Number: 1035654-66-0
  • MF: C24H29N3O8
  • MW: 487.50200
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Aminooxy-PEG4-alcohol

Aminooxy-PEG4-alcohol is a non-cleavable 4 unit PEG ADC linker used in the synthesis of antibody-drug conjugates (ADCs)[1]. Aminooxy-PEG4-alcohol is also a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[2].

  • CAS Number: 106492-60-8
  • MF: C8H19NO5
  • MW: 209.24000
  • Catalog: ADC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Nicardipine

Nicardipine(YC-93) is a calcium channel blocker that has been widely used to control blood pressure in severe hypertension following events such as ischemic stroke, traumatic brain injury, and intracerebral hemorrhage.

  • CAS Number: 55985-32-5
  • MF: C26H29N3O6
  • MW: 479.52500
  • Catalog: Calcium Channel
  • Density: 1.23 g/cm3
  • Boiling Point: 603.4ºC at 760 mmHg
  • Melting Point: 136-138ºC
  • Flash Point: 318.7ºC

2-Amino-8-oxononanoic acid

2-Amino-8-oxononanoic acid is an amino acid, incorporation into proteins in E.coli in genetic. 2-Amino-8-oxononanoic acid is efficient in labeling of proteins with different probes with a site-specific manner under a mild condition close to the physiological pH[1].

  • CAS Number: 1219456-00-4
  • MF: C9H17NO3
  • MW: 187.24
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

dl-alanyl-dl-norvaline

2-(2-Aminopropanamido)pentanoic acid is a valine derivative[1].

  • CAS Number: 2325-18-0
  • MF: C8H16N2O3
  • MW: 188.22400
  • Catalog: Others
  • Density: 1.136 g/cm3
  • Boiling Point: 410.4ºC at 760 mmHg
  • Melting Point: 240-242ºC
  • Flash Point: 202ºC

Antipyrine

Antipyrine is an analgesic and antipyretic agent.Target: OthersAntipyrine is an analgesic and antipyretic that has been given by mouth and as ear drops. Antipyrine is often used in testing the effects of other drugs or diseases on drug-metabolizing enzymes in the liver. Antipyrine was one of the first important synthetic drugs. antipyrine went into widespread clinical use as an antipyretic the same year it was synthesized. Two years after its introduction, reports began to appear of its analgesic effects and in the succeeding years, as the use of antipyrine as an antipyretic declined, it gained considerable popularity as an analgesic. The plasma halflife of antipyrine is significantly longer and the clearance significantly lower in the elderly group. This finding of an impaired metabolism of antipyrine in the elderly has since been confirmed in a much larger study and subsequently other drugs have been shown to be metabolized more slowly in this age group [1].

  • CAS Number: 60-80-0
  • MF: C11H12N2O
  • MW: 188.226
  • Catalog: Inflammation/Immunology
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 319.0±0.0 °C at 760 mmHg
  • Melting Point: 109-111 °C(lit.)
  • Flash Point: 114.8±15.0 °C

N-(Mal-PEG6)-N-bis(PEG3-amine) TFA

N-(Mal-PEG6)-N-bis(PEG3-amine) is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 2055040-99-6
  • MF: C38H71N5O16
  • MW: 853.99
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

H-Asp(OMe)-OH·HCl

β-Methyl L-aspartate hydrochloride is an aspartic acid derivative[1].

  • CAS Number: 16856-13-6
  • MF: C5H10ClNO4
  • MW: 183.590
  • Catalog: Others
  • Density: 1.299g/cm3
  • Boiling Point: 301.7ºC at 760mmHg
  • Melting Point: 191-193°C
  • Flash Point: 136.3ºC

14,17-epidioxy-28-nor-15-taraxerene-2,3-diol

Baccatin is a compound isolated from the roots of Sapium Sebiferum[1].

  • CAS Number: 66107-60-6
  • MF: C29H46O4
  • MW: 458.67
  • Catalog: Others
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 515.3±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 265.5±30.1 °C

Guanine-13C

Guanine-13C is the 13C labeled Guanine[1]. Guanine (2-Aminohypoxanthine) is one of the fundamental components of nucleic acids (DNA and RNA). Guanine is a purine derivative, consisting of a fused pyrimidine-imidazole ring system with conjugated double bonds.

  • CAS Number: 201489-20-5
  • MF: C413CH5N5O
  • MW: 152.12
  • Catalog: DNA/RNA Synthesis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Etifoxine hydrochloride

Etifoxine Hcl(HOE 36-801) is potentiator of GABAA receptor function in cultured neurons. Etifoxine preferentially acts on β2 or β3 subunit-containing GABAA receptors. IC50 value:Target: GABAA receptorEtifoxine exhibits anxiolytic activity in rodents and humans with no sedative, myorelaxant or mnesic side effects. Etifoxine acts as a ligand of the translocator protein (TSPO); promotes axonal regeneration.

  • CAS Number: 56776-32-0
  • MF: C17H18Cl2N2O
  • MW: 337.244
  • Catalog: GABA Receptor
  • Density: 1.2g/cm3
  • Boiling Point: 421.2ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 208.5ºC

Isosaxalin

Isosaxalin is a natural product isolated from Murraya koeningii[1].

  • CAS Number: 55481-86-2
  • MF: C16H15ClO5
  • MW: 322.74
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 531.2±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 275.1±30.1 °C

Propyl Gallate

Propyl gallate is a common food antioxidant. Propyl gallate can inhibit the production of acrolein, glyoxal and methylglyoxal[1][2].

  • CAS Number: 121-79-9
  • MF: C10H12O5
  • MW: 212.199
  • Catalog: Apoptosis
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 448.6±40.0 °C at 760 mmHg
  • Melting Point: 146-149 °C(lit.)
  • Flash Point: 181.3±20.8 °C

Cannabisin D

Cannabisin D inhibits proliferation and migration of glioblastoma cells through MAPKs signaling[1].

  • CAS Number: 144506-19-4
  • MF: C36H36N2O8
  • MW: 624.68
  • Catalog: p38 MAPK
  • Density: 1.334±0.06 g/cm3
  • Boiling Point: 965.7±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 537.9±34.3 °C

6,7-DIHYDROXY-4-(TRIFLUOROMETHYL)COUMARIN

Antiproliferative agent-35 (Compound 4) inhibits the proliferation of B16 and A549 cells, with IC50s of 13.2 and 9.2 μM resspectively[1].

  • CAS Number: 82747-36-2
  • MF: C10H5F3O4
  • MW: 246.14
  • Catalog: Cancer
  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 380.5±42.0 °C at 760 mmHg
  • Melting Point: 214-216ºC(lit.)
  • Flash Point: 183.9±27.9 °C

MJ33 lithium

MJ33 lithium is an active-site-directed, specific, competitive, and reversible phospholipase A2 (PLA2) inhibitor. MJ33 lithium blocks the calcium-independent phospholipase A2 (iPLA2) activity of Prdx6[1]. MJ33 lithium has a critical effect on inflammatory brain damage[2].

  • CAS Number: 1135306-36-3
  • MF: C22H43F3LiO7P
  • MW: 514.48
  • Catalog: Phospholipase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Epifriedelanol

Epifriedelanol is a triterpenoid isolated from the root bark of Ulmus davidiana, with antitumor activity[1]. Epifriedelanol inhibits cellular senescence in human primary cells[2].

  • CAS Number: 16844-71-6
  • MF: C30H52O
  • MW: 428.733
  • Catalog: Cancer
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 478.3±13.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 199.6±12.3 °C

Kotanin A

Kotanin is a metabolite of Aspergillus glaucus[1].

  • CAS Number: 27909-08-6
  • MF: C24H22O8
  • MW: 438.42700
  • Catalog: Others
  • Density: 1.36g/cm3
  • Boiling Point: 658.2ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 284.5ºC

Cardamonin

Cardamonin is a novel antagonist of hTRPA1 cation channel with an IC50 of 454 nM.

  • CAS Number: 19309-14-9
  • MF: C16H14O4
  • MW: 270.280
  • Catalog: TRP Channel
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 484.5±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 182.7±22.2 °C

3,3'-Disulfanediyldipropanoic acid

Dithiodipropionic acid can interact with CPUL1 (HY-151802, a TrxR inhibitor) to form nanoaggregates (CPUL1-DA NAs). CPUL1-DA NAs generates more abundant ROS to induce cell apoptosis than that of free CPUL1, and improves antitumor efficacy against HUH7 cancer cells[1].

  • CAS Number: 1119-62-6
  • MF: C6H10O4S2
  • MW: 210.271
  • Catalog: Apoptosis
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 431.1±30.0 °C at 760 mmHg
  • Melting Point: 155-158 °C(lit.)
  • Flash Point: 214.5±24.6 °C

SY-1365

SY-1365 is a highly selective covalent inhibitor of CDK7. SY-1365 possesses therapeutic potential in both hematological and solid tumors[1].

  • CAS Number: 1816989-16-8
  • MF: C31H35ClN8O2
  • MW: 587.12
  • Catalog: CDK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

R-7128

Mericitabine (R-7128) is a nucleoside inhibitor of the HCV NS5B polymerase that acts as an RNA chain terminator and prevents elongation of RNA transcripts during replication.

  • CAS Number: 940908-79-2
  • MF: C18H26FN3O6
  • MW: 399.41400
  • Catalog: HCV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cobimetinib

Cobimetinib (GDC-0973, RG7420) is a potent, selective and oral MEK inhibitor with an IC50 of 4.2 nM for MEK1.

  • CAS Number: 934660-93-2
  • MF: C21H21F3IN3O2
  • MW: 531.310
  • Catalog: MEK
  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 565.9±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 296.1±30.1 °C

MK-0773

MK-0773 is a selective androgen receptor modulators (SARMs) that binds to AR with an IC50 of 6.6 nM.

  • CAS Number: 606101-58-0
  • MF: C27H34FN5O2
  • MW: 479.590
  • Catalog: Endocrinology
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 754.2±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 409.9±32.9 °C

Multiflorin A

Multiflorin A is an active ingredient derived from Pruni semen. Multiflorin A has laxative activity. Multiflorin A inhibits intestinal glucose absorption and promotes bacterial metabolism[1].

  • CAS Number: 1350028-90-8
  • MF: C29H32O16
  • MW: 636.56
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A