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

CTS-1027

CTS-1027 is a potent small molecule inhibitor of MMPs, with IC50s of 0.3 nM, 0.5 nM for MMP2, MMP13, respectively, and has > 1,000 fold selectivity over MMP1.

  • CAS Number: 193022-04-7
  • MF: C19H20ClNO6S
  • MW: 425.88300
  • Catalog: MMP
  • Density: 1.388g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

β-Casomorphin (1-3) amide acetate salt

β-Casomorphin (1-3), amide is a peptide fragment of β-Casomorphin with 3 amino acid.

  • CAS Number: 80705-23-3
  • MF: C23H28N4O4
  • MW: 424.493
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 802.2±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 439.0±34.3 °C

Lactobionic acid

Lactobionic acid is a bionic acid naturally found in the Caspian Sea yogurt and chemically constituted of a gluconic acid bonded to a galactose. Lactobionic acid has antioxidant, antimicrobial, chelating, stabilizer, acidulant, and moisturizing properties[1].

  • CAS Number: 96-82-2
  • MF: C12H22O12
  • MW: 358.296
  • Catalog: Bacterial
  • Density: 1.8±0.1 g/cm3
  • Boiling Point: 864.7±65.0 °C at 760 mmHg
  • Melting Point: 113-118 °C(lit.)
  • Flash Point: 319.1±27.8 °C

Hydroxy-PEG8-Boc

Hydroxy-PEG8-Boc is a PEG-based PROTAC linker can be used in the synthesis of PROTACs.

  • CAS Number: 1334177-84-2
  • MF: C23H46O11
  • MW: 498.605
  • Catalog: PROTAC Linker
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 549.5±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 168.6±22.2 °C

Previtamin D3

Previtamin D3 is an intermediate in the production of cholecalciferol (vitamin D3)[1].

  • CAS Number: 1173-13-3
  • MF: C27H44O
  • MW: 384.63800
  • Catalog: Metabolic Disease
  • Density: 1.017g/cm3
  • Boiling Point: 496ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 214.1ºC

Chlorothalonil

Chlorothalonil is a broad spectrum fungicide and is effective in protecting plants against fungal diseases caused mainly by Phytophthora infestans and Alternaria solani. Chlorothalonil is used for controlling of fungal foliar diseases of vegetables and crops[1][2].

  • CAS Number: 1897-45-6
  • MF: C8Cl4N2
  • MW: 265.911
  • Catalog: Fungal
  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 350.5±37.0 °C at 760 mmHg
  • Melting Point: 250-251ºC
  • Flash Point: 153.8±20.7 °C

DNA-PK-IN-7

DNA-PK-IN-7 is a potent DNA-PK inhibitor with an IC50 of 1 nM (WO2021104277A1, compound 5)[1].

  • CAS Number: 2646592-18-7
  • MF: C19H21N9O2
  • MW: 407.43
  • Catalog: DNA-PK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Trimethobenzamide

Trimethobenzamide (Ro 2-9578 free base) is a blocker of the D2 receptor. Trimethobenzamide is an antiemetic used to prevent nausea and vomiting[1].

  • CAS Number: 138-56-7
  • MF: C21H28N2O5
  • MW: 388.45700
  • Catalog: Dopamine Receptor
  • Density: 1.131 g/cm3
  • Boiling Point: 506.9ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 260.4ºC

Sartorypyrone B

Sartorypyrone B is a 2β-acetoxyl analogue of chevalone C. Sartorypyrone B is yielded from the ethyl acetate extract of the culture of the marine sponge-associated fungus Neosartorya tsunodae (KUFC 9213). Sartorypyrone B exhibits strong growth inhibitory activity, having GI50s of 17.8, 20.5, and 25.0 μM, respectively, for MCF-7, NCI-H460, and A375-C5. Sartorypyrone B has the potential for the research of breast adenocarcinoma, non-small cell lung cancer, and melanoma diseases[1].

  • CAS Number: 1452396-11-0
  • MF: C30H42O7
  • MW: 514.650
  • Catalog: Cancer
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 582.6±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 244.0±30.2 °C

Acetrizoic Acid

Acetrizoic acid is a molecule used as a contrast medium.

  • CAS Number: 85-36-9
  • MF: C9H6I3NO3
  • MW: 556.862
  • Catalog: Others
  • Density: 2.8±0.1 g/cm3
  • Boiling Point: 547.1±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 284.7±30.1 °C

Phenyl benzoate

Phenyl benzoate is a benzoate ester obtained by the formal condensation of phenol with benzoic acid. Phenyl benzoate is a chloride transport blocker, inhibits Cl--dependent Glu accumulation into vesicles. Phenyl benzoate can be used as preservative in cosmetic products[1][2].

  • CAS Number: 93-99-2
  • MF: C13H10O2
  • MW: 198.217
  • Catalog: Chloride Channel
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 314.0±11.0 °C at 760 mmHg
  • Melting Point: 68-70 °C(lit.)
  • Flash Point: 128.9±16.7 °C

NCT-501 hydrochloride

NCT-501 hydrochloride is a potent and selective theophylline-based inhibitor of aldehyde dehydrogenase 1A1 (ALDH1A1), inhibits hALDH1A1 with IC50 of 40 nM, typically shows better selectivity over other ALDH isozymes and other dehydrogenases (hALDH1B1, hALDH3A1, and hALDH2, IC50 >57 μM)[1][2].

  • CAS Number: 2080306-22-3
  • MF: C21H33ClN6O3
  • MW: 452.98
  • Catalog: Aldehyde Dehydrogenase (ALDH)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Aquilarone C

Aquilarone C is a chromone derivative with anti-inflammatoryeffects[1].

  • CAS Number: 1404479-46-4
  • MF: C18H20O7
  • MW: 348.35
  • Catalog: Inflammation/Immunology
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

g418

G-418 (Geneticin) is an aminoglycoside antibiotic with a structure similar to gentamicin. It is toxic to both eukaryotic and prokaryotic cells and works by interfering with protein synthesis[1].

  • CAS Number: 49863-47-0
  • MF: C20H40N4O10
  • MW: 496.55200
  • Catalog: Bacterial
  • Density: 1.47 g/cm3
  • Boiling Point: 760.3ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 413.6ºC

Src Optimal Peptide Substrate

Src Optimal Peptide Substrate is a highly specific Src substrate. Src Optimal Peptide Substrate can used to measure the Src activity[1].

  • CAS Number: 168202-45-7
  • MF: C81H127N19O27
  • MW: 1798.99
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

6-Formyl-isoophiopogonanone B

6-Formyl-isoophiopogonanone B is a homoisoflavonoid, which can be isolated from Ophiopogon japonicus[1].

  • CAS Number: 88700-30-5
  • MF: C19H18O6
  • MW: 342.34
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ARC-239

ARC 239 is an α2B/C-adrenergic receptor antagonist with pKi of 7.06 and 6.95 for rat kidney α2B and human α2C, respectively. ARC 239 also inhibits 5-HT1A receptor with a Ki of 63.1 nM[1][2].

  • CAS Number: 67339-62-2
  • MF: C24H29N3O3
  • MW: 407.51
  • Catalog: 5-HT Receptor
  • Density: 1.167g/cm3
  • Boiling Point: 595.8ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 314.1ºC

1,3-DIMETHYLPSEUDOURIDINE

1,3-Dimethyl pseudouridine is a purine nucleoside analogue. 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: 64272-68-0
  • MF: C11H16N2O6
  • MW: 272.25
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

boc-asp-nh2

Boc-Asp-NH2 is an aspartic acid derivative[1].

  • CAS Number: 74244-17-0
  • MF: C9H16N2O5
  • MW: 232.23400
  • Catalog: Others
  • Density: 1.253 g/cm3
  • Boiling Point: 462.7ºC at 760 mmHg
  • Melting Point: 150-154ºC
  • Flash Point: N/A

Aminooxy-PEG3-azide

Aminooxy-PEG3-azide is a non-cleavable 3 unit PEG ADC linker used in the synthesis of antibody-drug conjugates (ADCs)[1]. Aminooxy-C2-PEG3-azide is also a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[2].

  • CAS Number: 1306615-51-9
  • MF: C8H18N4O4
  • MW: 234.25300
  • Catalog: ADC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cephalexin (lysine)

Cephalexin (Cefalexin) lysine is a derivative of Cephalexin with lysine. Cephalexin is a potent, orally active and the first-generation cephalosporin antibiotic. Cephalexin kills gram-positive and some gram-negative bacteria by disrupting the growth of the bacterial cell wall. Cephalexin monohydrate is used for the research of pneumonia, strep throat, and bacterial endocarditis, et al[1].

  • CAS Number: 53950-14-4
  • MF: C22H31N5O6S
  • MW: 493.58
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

H-Gly-Ala-Gly-OH

Glycylalanylglycine is a biologically active peptide.

  • CAS Number: 16422-05-2
  • MF: C7H13N3O4
  • MW: 203.19600
  • Catalog: Others
  • Density: 1.314g/cm3
  • Boiling Point: 604.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 319.5ºC

Sevelamer hydrochloride

Sevelamer Hcl is a phosphate binding drug used to treat hyperphosphatemia in patients with chronic kidney disease; consists of polyallylamine that is crosslinked with epichlorohydrin.

  • CAS Number: 152751-57-0
  • MF: (C3H7N.C3H5ClO)x.xHCl
  • MW: 186.08 (monomer)
  • Catalog: FXR
  • Density: N/A
  • Boiling Point: 116.1ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 33.9ºC

Thymol Blue sodium

Thymol Blue sodium is an acid-base indicator used to indicate changes in pH. Thymol Blue sodium fades from red to yellow at pH 1.2 to 2.8 and from yellow to blue at pH 8.0 to 9.6[1].

  • CAS Number: 62625-21-2
  • MF: C27H29NaO5S
  • MW: 487.564
  • Catalog: Others
  • Density: 0.979 g/mL at 25 °C
  • Boiling Point: N/A
  • Melting Point: 283-285 °C (dec.)(lit.)
  • Flash Point: N/A

Propiconazole-d7

Propiconazole-d7 is the deuterium labeled Propiconazole. Propiconazole is a broad-spectrum triazole fungicide that inhibits the conversion of lanosterol to ergosterol, leading to fungal cell membrane disruption. Propiconazole inhibits S. cerevisiae, but not rat liver, microsomal cytochrome P450 (IC50s=0.04 and >200 µM, respectively). Propiconazole inhibits the growth of T. deformans and R. stolonifer (ED50s=0.073 and 4.6 µg/mL, respectively). Propiconazole increases production of reactive oxygen species (ROS)[1].

  • CAS Number: 1246818-14-3
  • MF: C15H10D7Cl2N3O2
  • MW: 349.263
  • Catalog: Fungal
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 480.0±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 244.1±31.5 °C

Heishuixiecaoline A

Heishuixiecaoline A is a germacrane-type sesquiterpenoid. Heishuixiecaoline A shows protective effect on the neurotoxicity of PC12 cells induced by Aβ25-35[1].

  • CAS Number: 1469493-85-3
  • MF: C17H24O3
  • MW: 276.37
  • Catalog: Neurological Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Vevorisertib

Vevorisertib (ARQ 751) is an orally active, potent and selective pan-AKT serine/threonine kinase inhibitor against AKT1 (IC50=0.55 nM), AKT2 (IC50=0.81 nM), and AKT3 (IC50=1.31 nM). Vevorisertib, as a single agent or in combination with other anti-cancer agents, can be used for the research of solid tumors with PIK3CA / AKT / PTEN mutations[1][2][3][4].

  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

5-Carboxamidotryptamine maleate

5-Carboxamidotryptamine maleate (5-CT maleate) is a potent 5-HT1A, 5-HT1B, 5-HT1D, 5-HT5 and 5-HT7 receptors agonist[1][2][3].

  • CAS Number: 74885-72-6
  • MF: C15H17N3O5
  • MW: 319.31
  • Catalog: 5-HT Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

a2e

Pyridinium bisretinoid A2E (A2E)is an initiator of blue-light-induced apoptosis. Photoactivation of Pyridinium bisretinoid A2E mediates autophagy and the production of reactive oxygen species[1][2].

  • CAS Number: 173449-96-2
  • MF: C42H58NO+
  • MW: 592.91600
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2-Methyl-L-serine

2-Amino-3-hydroxy-2-methylpropanoic acid is a serine derivative[1].

  • CAS Number: 5424-29-3
  • MF: C4H9NO3
  • MW: 119.119
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 345.8±32.0 °C at 760 mmHg
  • Melting Point: 253-263ºC
  • Flash Point: 162.9±25.1 °C