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

SKF 81297 hydrobromide

SKF 81297 hydrobromide is a potent and selective dopamine D1 receptor agonist[1].

  • CAS Number: 67287-39-2
  • MF: C16H17BrClNO2
  • MW: 370.669
  • Catalog: Dopamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ODN 2216

ODN 2216 is a TLR9 (toll-like receptor 9) ligand or agonist. ODN 2216 induces high amounts of IFN-α and IFN-β. ODN 2216 induces IFN-α by pDC (plasmacytoid DC) and IL-12 (p40) production by DC (dendritic cells). ODN 2216 stimulates IFN-γ production in peripheral blood mononuclear cells (PBMC), which is indirect and mediated by IFN-α/β. ODN 2216 can activate NK cells and promote IFN-γ production of TCR-triggered CD4+ T cells[1][2][3][4].

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

Isorhamnetin 3-O-galactoside

Isorhamnetin 3-O-galactoside (Cacticin), a flavonoid glycoside isolated from Artemisia capillaris Thunberg, which ameliorates CCl4-induced hepatic damage by enhancing the anti-oxidative defense system and reducing the inflammatory signaling pathways. Isorhamnetin 3-O-galactoside (Cacticin) has antithrombotic and anti-inflammatory activities[1][2][3].

  • CAS Number: 6743-92-6
  • MF: C22H22O12
  • MW: 478.403
  • Catalog: Cardiovascular Disease
  • Density: 1.75±0.1 g/cm3
  • Boiling Point: 834.4±65.0 °C at 760 mmHg
  • Melting Point: 267-269 ºC
  • Flash Point: 291.3±27.8 °C

Prepro VIP (81-122), human

Prepro VIP (81-122), human is a prepro-vasoactive intestinal polypeptide (VIP) derived peptide, corresponding to residues 81-122. Peptide histidine valine 42 (PHV-42) has been designated to correspond exactly to Prepro VIP (81-122), which reduces both the force and frequency of spontaneous contractions of isolated rat uterus[1].

  • CAS Number: 111366-38-2
  • MF: C202H325N53O64S
  • MW: 4552.13
  • Catalog: Cardiovascular Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Umbelliferone 7-O-Rutinoside

Umbelliferone 7-O-Rutinoside (Compound 9) is a natural product that can be isolated from the stems of Clausena emarginata[1].

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

m-PEG2-Br

m-PEG2-Br is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 54149-17-6
  • MF: C5H11BrO2
  • MW: 183.044
  • Catalog: PROTAC Linker
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 184.4±15.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 73.9±0.0 °C

2'-Deoxy-2'-fluoro-5-iodouridine

2'-Deoxy-2'-fluoro-5-iodouridine 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: 55612-21-0
  • MF: C9H10FIN2O5
  • MW: 372.09
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: 2.2±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 216-218 °C
  • Flash Point: N/A

HSK16149

HSK16149 is a novel ligand of voltage-gated calcium channel (VGCC) α 2 δ subunit.

  • CAS Number: 2209104-84-5
  • MF: C12H19NO2
  • MW: 209.28
  • Catalog: Calcium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Boc-Tyr-OtBu

Boc-Tyr-OtBu is a tyrosine derivative[1].

  • CAS Number: 18938-60-8
  • MF: C18H27NO5
  • MW: 337.41100
  • Catalog: Others
  • Density: N/A
  • Boiling Point: 476.0±40.0°C
  • Melting Point: N/A
  • Flash Point: N/A

HSK0935

HSK0935 is a potent, highly selective and orally available SGLT2 inhibitor with an IC50 of 1.3 nM. Antihyperglycemic activities[1].

  • CAS Number: 1638851-44-1
  • MF: C22H25ClO7
  • MW: 436.88
  • Catalog: SGLT
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Glycine-13C2,15N

Glycine-13C2,15N is the 13C- and 15N-labeled Glycine. Glycine is an inhibitory neurotransmitter in the CNS and also acts as a co-agonist along with glutamate, facilitating an excitatory potential at the glutaminergic N-methyl-D-aspartic acid (NMDA) receptors.

  • CAS Number: 211057-02-2
  • MF: 13C2H515NO2
  • MW: 78.045
  • Catalog: iGluR
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 240ºC (dec.)(lit.)
  • Flash Point: N/A

Calcifediol

Calcifediol (monohydrate) is a major circulating metabolite of vitamin D3, acting as a competitive inhibitor with an apparent Ki of 3.9 μM, suppresses PTH secretion and mRNA (ED50=2 nM).

  • CAS Number: 63283-36-3
  • MF: C27H46O3
  • MW: 418.65
  • Catalog: VD/VDR
  • Density: N/A
  • Boiling Point: 529.2ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 221.4ºC

UVARIGRANOL C

Uvarigranol C, a polyoxygenated cyclohexene, is isolated from the stems of Uvaria boniana Finet. (Annonaceae)[1].

  • CAS Number: 172104-04-0
  • MF: C23H24O7
  • MW: 412.432
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 554.0±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 188.1±23.6 °C

(Rac)-LB-100

(Rac)-LB-100 is the racemate of LB-100. LB-100 is a protein phosphatase 2A (PP2A) inhibitor[1].

  • CAS Number: 2061038-65-9
  • MF: C13H20N2O4
  • MW: 268.31
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ifetroban

Ifetroban is a long-acting thromboxane A2 receptor antagonist, with antiplatelet activity[1].

  • CAS Number: 143443-90-7
  • MF: C25H32N2O5
  • MW: 440.53200
  • Catalog: Prostaglandin Receptor
  • Density: 1.206g/cm3
  • Boiling Point: 663.6ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 355.1ºC

ML RR-S2 CDA

ADU-S100 is an inducer of STING (stimulator of interferon genes). ADU-S100 has enhanced binding affinity to STING and activate all known human STING alleles.

  • CAS Number: 1638241-89-0
  • MF: C20H24N10O10P2S2
  • MW: 690.54
  • Catalog: STING
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Quinotolast sodium

Quinotolast sodium in the concentration range of 1-100 μg/mL inhibits histamine, LTC4 and PGD2 release in a concentration-dependent manner.

  • CAS Number: 101193-62-8
  • MF: C17H12N6NaO3
  • MW: 371.30500
  • Catalog: Histamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

4H-1-Benzopyran-4-one,2,3-dihydro-5-hydroxy-3-[(4-hydroxyphenyl)methyl]-7-methoxy-

5-Hydroxy-3-(4-hydroxybenzyl)-7-methoxychroman-4-one (4a) is a natural compound[1].

  • CAS Number: 108001-32-7
  • MF: C17H16O5
  • MW: 300.30600
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SIBIRICINE

Sibiricine (Compound 8) is an isoquinoline alkaloid derived from the medicinal plant Corydalis crispa. Sibiricine has significant anti-inflammatory activity on TNF-α production by LPS-activated THP-1 cells[1].

  • CAS Number: 24181-66-6
  • MF: C20H17NO6
  • MW: 367.352
  • Catalog: Inflammation/Immunology
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 547.4±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 284.8±30.1 °C

Gimsilumab

Gimsilumab (MORAb-022) is a humanized anti-GM-CSF monoclonal antibody. Gimsilumab has the potential for the research of COVID-19 and rheumatoid arthritis (RA)[1][2].

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

endo-BCN-PEG4-acid

endo-BCN-PEG4-acid is a PEG-based PROTAC linker can be used in the synthesis of PROTACs.

  • CAS Number: 1421932-54-8
  • MF: C22H35NO8
  • MW: 441.515
  • Catalog: PROTAC Linker
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 608.2±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 321.6±31.5 °C

Hesperetin

Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity.

  • CAS Number: 520-33-2
  • MF: C16H14O6
  • MW: 302.279
  • Catalog: Neurological Disease
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 586.2±50.0 °C at 760 mmHg
  • Melting Point: 230-232°C
  • Flash Point: 223.0±23.6 °C

Diosgenin-3-O-rhamnosyl(1→2)[glucosyl(1→6)]glucoside

Diosgenin-3-O-rhamnosyl(1→2)[glucosyl(1→6)]glucoside (compound 9) is a steroidal saponin, which can be obtained from Paris polyphylla var., Yunnan pine (yunnanensis) Isolated[1].

  • CAS Number: 1072072-37-7
  • MF: C45H72O17
  • MW: 885.04
  • Catalog: Others
  • Density: 1.42±0.1 g/cm3(Predicted)
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Bupranolol

Bupranolol is an orally active, competitive and non-selective β-adrenoceptor antagonist without intrinsic sympathomimetic activity[1].

  • CAS Number: 14556-46-8
  • MF: C14H22ClNO2
  • MW: 271.78300
  • Catalog: Adrenergic Receptor
  • Density: 1.098g/cm3
  • Boiling Point: 396.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 193.5ºC

AA38-3

AA38-3 is a serine hydrolase (SH) inhibitor. AA38-3 can inhibit three SHs, ABHD6, ABHD11, and FAAH[1].

  • CAS Number: 65815-76-1
  • MF: C12H14N2O4
  • MW: 250.25
  • Catalog: FAAH
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 397.5±34.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 194.2±25.7 °C

6,6-DIMETHYL-3-(5-METHYL-3-OXO-2-(4-(TRIFLUOROMETHOXY)PHENYL)-2,3-DIHYDRO-1H-PYRAZOL-4-YL)-1-PHENYL-3-(TRIFLUOROMETHYL)-6,7-DIHYDRO-1H-INDOLE-2,4(3H,5H)-DIONE

ELOVL6-IN-2 is a potent, orally active and selective ELOVL6 inhibitor. ELOVL6-IN-2 inhibits mouse ELOVL6 activities, with an IC50 value of 34 nM[1].

  • CAS Number: 1067647-43-1
  • MF: C28H23F6N3O4
  • MW: 579.49000
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Totarol

(+)-Totarol is a diterpenoid compound isolated from Podocarpus spp.. (+)-Totarol is a potent antioxidant and antibacterial agent[1].

  • CAS Number: 511-15-9
  • MF: C20H30O
  • MW: 284.479
  • Catalog: Infection
  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 346.1±37.0 °C at 760 mmHg
  • Melting Point: 128-132ºC(lit.)
  • Flash Point: 163.0±15.1 °C

Glucosylceramide synthase-IN-2

Glucosylceramide synthase-IN-2 (compound T-690) is a potent, brain-penetrant and orally active glucosylceramide synthase (GCS) inhibitor with IC50s of 15 nM and 190 nM for human GCS and mouse GCS, respectively.Glucosylceramide synthase-IN-2 exhibits noncompetitive type inhibition with C8-ceramide and UDP-glucose.Glucosylceramide synthase-IN-2 can be used for Gaucher's disease research[1].

  • CAS Number: 2597958-02-4
  • MF: C22H20F3N3O4
  • MW: 447.41
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ilicol

Ilicol is a natural product isolated from the roots of Saussurea lappa Clarke. Ilicol inhibits root growth and shows IC50 values of 1.22, 2.90, 7.35, 8.07 mM against P. miliaceum , A. sativa, L. sativa , and R. sativus, respectively. Ilicol reduces Allium cepa cell division without chromosome aberration[1].

  • CAS Number: 72715-02-7
  • MF: C15H26O2
  • MW: 238.37
  • Catalog: Others
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 350.9±25.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 158.5±17.8 °C

1-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid

1-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid is from Cordyceps bassiana, which is one of Cordyceps species with anti-oxidative, anti-cancer, anti-inflammatory, anti-diabetic, anti-obesity, anti-angiogenic, and anti-nociceptive activities. 1-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid targets to block AP-1-mediated luciferase activity, implying it has an anti-inflammatory function[1].

  • CAS Number: 3719-45-7
  • MF: C7H7NO3
  • MW: 153.13500
  • Catalog: Inflammation/Immunology
  • Density: 1.381g/cm3
  • Boiling Point: 329.6ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 153.2ºC