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

Nikethamide

Nikethamide, one of the respiratory central stimulants, is used to treat respiratory failure in clinical practice.

  • CAS Number: 59-26-7
  • MF: C10H14N2O
  • MW: 178.231
  • Catalog: Others
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 298.0±0.0 °C at 760 mmHg
  • Melting Point: 23 °C(lit.)
  • Flash Point: 141.1±20.4 °C

Alpinone 3-acetate

3-Acetylpinobanksin-7-methyl ether is a natural product that can be isolated from propolis[1].

  • CAS Number: 139906-49-3
  • MF: C18H16O6
  • MW: 328.316
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CaLL

CaLL is an antimicrobial peptide. CaLL has antibacterial activity against B. anthracis, B. anthracis (vegetative), and B. cepacia (MIC: 7.8, 31.3, 31.3 μg/mL)[1].

  • CAS Number: 1228093-67-1
  • MF: C136H224N38O25
  • MW: 2791.47
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

KRAS G12C inhibitor 55

KRAS G12C inhibitor 55 (Compound 1) is a KRAS G12C inhibitor[1].

  • CAS Number: 2508134-76-5
  • MF: C36H40F3N7O2
  • MW: 659.74
  • Catalog: Ras
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Laurycolactone B

Laurycolactone B is a natural product from Eurycoma longifolia Jack[1].

  • CAS Number: 85643-77-2
  • MF: C18H20O5
  • MW: 316.34800
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Fraxidin

Fraxidin is a class of coumarin isolated from the roots of Jatropha podagrica, exhibits antibacterial activity against Bacillus subtilis with an inhibition zone of 12 mm at a concentration of 20 µg/disk[1][2].

  • CAS Number: 525-21-3
  • MF: C11H10O5
  • MW: 222.194
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 424.2±45.0 °C at 760 mmHg
  • Melting Point: 196-197ºC
  • Flash Point: 171.0±22.2 °C

TAK-659 hydrochloride

TAK-659 hydrochloride is a potent, selective and orally available spleen tyrosine kinase (Syk) inhibitor with an IC50 of 3.2 nM.

  • CAS Number: 1952251-28-3
  • MF: C17H22ClFN6O
  • MW: 380.85
  • Catalog: Syk
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2-[(2-Bromobenzyl)oxy]benzoic acid

ML-097 (CID-2160985) is a pan Ras-related GTPases activator that can activate Rac1, cell division cycle 42, Ras, and Rab7[1].

  • CAS Number: 743456-83-9
  • MF: C14H11BrO3
  • MW: 307.139
  • Catalog: Ras
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 445.4±25.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 223.2±23.2 °C

ODN 24987

ODN 24987 is a Guanine-modified inhibitory oligonucleotides (ODN), targeting TLR9. ODN 24987 can inhibit IL-6 and IFN-α release. ODN 24987 can be used for research immune disorders. ODN 24987 sequence: 5’-C-C-T-G-G-C-c7G-G-G-G-3’[1].

  • CAS Number: 1682661-48-8
  • MF:
  • MW:
  • Catalog: Toll-like Receptor (TLR)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Pomalidomide-C3-adavosertib

Pomalidomide-C3-adavosertib is a rapid and selective Wee1 degrader (IC50=3.58 nM). Pomalidomide-C3-adavosertib shows anti-cancer cell proliferation activity, and induces apoptosis[1].

  • CAS Number: 2414418-49-6
  • MF: C42H45N11O6
  • MW: 799.88
  • Catalog: Wee1
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Monomethyl auristatin E intermediate-9

Monomethyl auristatin E intermediate-9 is an intermediate reagent in the synthesis of Monomethyl auristatin E (HY-15162). Monomethyl auristatin E (MMAE) is a microtubule/tubulin inhibitor with anticancer activity. MMAE is widely used as the cytotoxic component (ADC Cytotoxin) of antibody-drug conjugates (ADCs)[1].

  • CAS Number: 120205-58-5
  • MF: C22H35NO5
  • MW: 393.52
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2,3′,4′,5-Tetrachlorobiphenyl-3,4,6-d3

2,3′,4′,5-Tetrachlorobiphenyl-3,4,6-d3 is the deuterium labeled 2,3′,4′,5-Tetrachlorobiphenyl[1].

  • CAS Number: 1219794-77-0
  • MF: C12H3D3Cl4
  • MW: 295.01
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cytarabine triphosphate

Cytarabine triphosphate (Ara-CTP), an active metabolite of Cytarabine, is a competitive inhibitor of DNA synthesis. Intracellular Cytarabine triphosphate levels can be used to predict chemosensitivity of leukemic blasts to Cytarabine[1].

  • CAS Number: 13191-15-6
  • MF: C10H18N3O13P3
  • MW: 481.18400
  • Catalog: DNA/RNA Synthesis
  • Density: 2.5g/cm3
  • Boiling Point: 849.2ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 467.4ºC

Arachidonyl trifluoromethyl ketone

AACOCF3 (Arachidonyl trifluoromethyl ketone) is a cell-permeant trifluoromethyl ketone analog of arachidonic acid. AACOCF3 is a potent and selective slow binding inhibitor of the 85-kDa cytosolic phospholipase A2 (cPLA2). AACOCF3 blocks production of arachidonate and 12-hydroxyeicosatetraenoic acid by calcium ionophore-challenged platelets. AACOCF3 inhibits glucose-induced insulin secretion from isolated rat islets. AACOCF3 has the potential for the research of cardiovascular disease[1][2][3].

  • CAS Number: 149301-79-1
  • MF: C21H31F3O
  • MW: 356.465
  • Catalog: Phospholipase
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 421.7±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 288.7±20.2 °C

4-Ethyl-2-methoxyphenol-d5

4-Ethyl-2-methoxyphenol-d5 is the deuterium labeled 4-Ethyl-2-methoxyphenol[1].

  • CAS Number: 1219803-12-9
  • MF: C9H12O2
  • MW: 152.190
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 246.5±20.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 107.8±0.0 °C

IL-17 modulator 5

IL-17 modulator 5 (compound 26) is a IL-17 inhibitor, with an IC50 of 1 nM[1].

  • CAS Number: 2724206-27-1
  • MF: C28H23F6N9O2
  • MW: 631.53
  • Catalog: Interleukin Related
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Yadanzioside A

Yadanziolide A, a quassinoid glycoside from Brucea javanica, has antitumor activity[1].

  • CAS Number: 95258-15-4
  • MF: C32H44O16
  • MW: 684.68200
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Pseudocoptisine acetate

Pseudocoptisine acetate, a quaternary alkaloid with a benzylisoquinoline skeleton, is isolated from the tubers of Corydalis turtschaninovii. Pseudocoptisine acetate shows anti-inflammatory properties[1].

  • CAS Number: 30426-66-5
  • MF: C21H17NO6
  • MW: 379.36
  • Catalog: ERK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Propyl paraben

Propylparaben is an antimicrobial agent, preservative, flavouring agent.

  • CAS Number: 94-13-3
  • MF: C10H12O3
  • MW: 180.201
  • Catalog: Bacterial
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 294.3±13.0 °C at 760 mmHg
  • Melting Point: 95-98 °C(lit.)
  • Flash Point: 124.6±12.6 °C

14:0-14:0 PC-d27

14:0-14:0 PC-d27 is deuterium labeled 14:0-14:0 PC.

  • CAS Number: 185906-02-9
  • MF: C36H45D27NO8P
  • MW: 705.10
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

TLR7 agonist 10

TLR7 agonist 10 is a purine nucleoside analog. Purine nucleoside analogs have broad antitumor activity targeting indolent lymphoid malignancies. Anticancer mechanisms in this process rely on inhibition of DNA synthesis, induction of apoptosis, etc[1].

  • CAS Number: 2389988-34-3
  • MF: C14H19N5O6
  • MW: 353.33
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Udenafil

Udenafil(DA8159) is a PDE5 inhibitor used in urology to treat erectile dysfunction.Target: PDE5Udenafil is an oral PDE5 inhibitor. Udenafil significantly increased cAMP and cGMP levels and were more highly distributed in the prostate than plasma. The T/P ratio of udenafil was higher than tadalafil. These findings may help in the assessment of the feasibility of using PDE5 Is to concurrently treat both LUTS and erectile dysfunction [1]. After 12 weeks of treatment, the patients treated with udenafil showed significantly greater change from baseline in the IIEF-EF domain score compared with placebo (placebo, 0.20; 100-mg udenafil, 7.52; and 200-mg udenafil, 9.93, respectively) (P < 0.0001). udenafil significantly enhanced the rates of successful penetration (SEP Q2) and maintenance of erection (SEP Q3) (P < 0.0001) [2].

  • CAS Number: 268203-93-6
  • MF: C25H36N6O4S
  • MW: 516.66
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.35g/cm3
  • Boiling Point: 697ºC at 760 mmHg(计算值)
  • Melting Point: 157-159°C
  • Flash Point: 375.3ºC(计算值)

ML 18

ML-18 is a non-peptide bombesin receptor subtype-3 (BRS-3) antagonist with an IC50 of 4.8 μM.

  • CAS Number: 1422269-30-4
  • MF: C32H35N5O5
  • MW: 569.651
  • Catalog: Bombesin Receptor
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 803.5±75.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 439.7±37.1 °C

Isoquercitrin

Quercetin-3-glucoside is a naturally occurring polyphenol that has antioxidant, anti-proliferative, and anti-inflammatory properties.Quercetin-3-glucoside alleviates ethanol-induced hepatotoxicity, oxidative stress, and inflammatory responses via the Nrf2/ARE antioxidant signaling pathway[1].Quercetin-3-glucoside regulates the expression of nitric oxide synthase 2 (NO2) via modulating the nuclear factor-κB (NF-κB) transcription regulation system. Quercetin-3-glucoside has high bioavailability and low toxicity, is a promising candidate agent to prevent birth defects in diabetic pregnancies[2].

  • CAS Number: 482-35-9
  • MF: C21H20O12
  • MW: 464.376
  • Catalog: NO Synthase
  • Density: 1.9±0.1 g/cm3
  • Boiling Point: 872.6±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 307.5±27.8 °C

Peonidin-3-O-arabinoside chloride

Peonidin-3-O-arabinoside chloride (Compound Ⅻ) is an anthocyanin that can be isolated from Vaccinium myrtillus L.[1].

  • CAS Number: 524943-91-7
  • MF: C21H21ClO10
  • MW: 468.838
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Oxantel

Oxantel (CP-14445), a m-oxyphenol derivative of Pyrantel (HY-12641), is a N-subtype AChR agonist. Oxantel is an anthelmintic, with excellent trichuricidal properties[1][2].

  • CAS Number: 36531-26-7
  • MF: C13H16N2O
  • MW: 216.27900
  • Catalog: nAChR
  • Density: 1.09g/cm3
  • Boiling Point: 383.1ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 185.5ºC

A-381393

A-381393 is a potent, selective, brain penetrate dopamine D4 receptor antagonist, with Kis of 1.5, 1.9 and 1.6 nM for human dopamine D4.4, D4.2, and D4.7 receptor, respectively, >2700-fold selectivity over D1, D2, D3 and D5 dopamine receptors. A-381393 shows moderate affinity for 5-HT2A (Ki, 370 nM)[1].

  • CAS Number: 726174-00-1
  • MF: C20H24N4
  • MW: 320.43
  • Catalog: Dopamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

NU6027

NU6027 is a potent and ATP-competitive inhibitor of both CDK1 and CDK2, with Kis of 2.5 µM and 1.3 µM, respectively. NU6027 is also a potent inhibitor of ATR and enhances hydroxyurea and cisplatin cytotoxicity in an ATR-dependent manner[1][2].

  • CAS Number: 220036-08-8
  • MF: C11H17N5O2
  • MW: 251.285
  • Catalog: ATM/ATR
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 549.2±60.0 °C at 760 mmHg
  • Melting Point: 252.5-253.7 °C(lit.)
  • Flash Point: 286.0±32.9 °C

O-2050-D3,13C

rel-O-2050 (Compound O-2050) is a neutral cannabinoid CB1 receptor antagonist. rel-O-2050 also decreases food intake in mice[1].

  • CAS Number: 851320-29-1
  • MF: C23H31NO4S
  • MW: 417.56200
  • Catalog: Cannabinoid Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

DFPM

A small molecule that rapidly downregulates abscisic acid (ABA)-dependent gene expression (IC50=3 and 1.5 uM for RD29B and RAB18 promoters), also inhibits ABA-induced stomatal closure; stimulates expression of plant defense-related genes, major early regulators of pathogen-resistance responses, including EDS1, PAD4, RAR1, and SGT1b, are required for DFPM-interference with ABA signal transduction, disrupts cytosolic Ca(2+) signaling and downstream anion channel activation in a PAD4-dependent manner.

  • CAS Number: 301338-95-4
  • MF: C16H15Cl2NOS
  • MW: 340.267
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 461.2±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 232.7±31.5 °C