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

1,3,5,6-Tetrahydroxyxanthone

1,3,5,6-Tetrahydroxyxanthone is a natural xanthone that can be isolated from Garcinia achachairu Rusby (Clusiaceae) branches. 1,3,5,6-Tetrahydroxyxanthone induces diuresis and saluresis in normotensive and hypertensive rats[1].

  • CAS Number: 5084-31-1
  • MF: C13H8O6
  • MW: 260.19900
  • Catalog: Cardiovascular Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

1,1-Dimethylurea-d6

1,1-Dimethylurea-d6 is the deuterium labeled 1,1-Dimethylurea[1].

  • CAS Number: 1219802-32-0
  • MF: C3H2D6N2O
  • MW: 94.15
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CXCR4 antagonist 5

CXCR4 antagonist 5 (compound 23) is a highly potent CXCR4 antagonist with an IC50 value of 8.8 nM. CXCR4 antagonist 5 can inhibit CXCL12-induced cytosolic calcium increase (IC50 = 0.02 nM) and inhibits CXCR4/CXLC12-mediated chemotaxis. CXCR4 antagonist 5 has good physicochemical properties and in vitro safety profiles, inhibiting CYP isozymes and hERG marginally or moderately[1].

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

solifenacin

Solifenacin is a novel muscarinic receptor antagonist with pKis of 7.6, 6.9 and 8.0 for M1, M2 and M3 receptors, respectively.

  • CAS Number: 242478-37-1
  • MF: C23H26N2O2
  • MW: 362.465
  • Catalog: mAChR
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 505.5±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 259.5±30.1 °C

Chaetoglobosin A

Chaetoglobosin A, the active principle within the extract of Penicillium aquamarinium, is a member of the cytochalasan family. Chaetoglobosin A preferentially induces apoptosis. Chaetoglobosin A targets filamentous actin in CLL cells and thereby induces cell-cycle arrest and inhibits membrane ruffling and cell migration[1].

  • CAS Number: 50335-03-0
  • MF: C32H36N2O5
  • MW: 528.63900
  • Catalog: Apoptosis
  • Density: 1.3 g/cm3
  • Boiling Point: 789.7ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 431.4ºC

N-Arachidonyl maleimide

N-Arachidonyl maleimide is a potent, irreversible inhibitor of monoacylglycerol lipase (MAGL) with an IC50 value of 140 nM[1].

  • CAS Number: 876305-42-9
  • MF: C24H35NO2
  • MW: 369.540
  • Catalog: MAGL
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 492.9±34.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 185.2±18.0 °C

PD-1/PD-L1-IN-22

PD-1/PD-L1-IN-22 (Example 2) is a small-molecule inhibitor of the PD-1/PD-L1 protein-protein interaction. PD-1/PD-L1-IN-22 blocks PD-1/PD-L1 with the IC50 of 0.732 μM. PD-1/PD-L1-IN-22 can be used for the research of cancers, infectious diseases and autoimmune diseases[1].

  • CAS Number: 2159063-12-2
  • MF: C25H26BrClN2O3
  • MW: 517.84
  • Catalog: PD-1/PD-L1
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

rubrofusarin-6-glucoside

Rubrofusarin 6-O-β-D-glucopyranoside, the glycoside of Rubrofusarin, is a protein tyrosine phosphatase 1B (PTP1B) inhibitor with the IC50 of 87.36 μM. Rubrofusarin 6-O-β-D-glucopyranoside can be used for the research of comorbid diabetes and depression[1].

  • CAS Number: 132922-80-6
  • MF: C21H22O10
  • MW: 434.39300
  • Catalog: Phosphatase
  • Density: 1.558g/cm3
  • Boiling Point: 734.8ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 260.2ºC

Sultopride-d5

Sultopride-d5 (LIN-1418-d5) is the deuterium labeled Sultopride. Sultopride (LIN-1418) is a selective antagonist of dopamine D2 receptor[1][2].

  • CAS Number: 1185004-43-6
  • MF: C17H21D5N2O4S
  • MW: 359.50
  • Catalog: Dopamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Arzoxifene

Arzoxifene (LY353381) is an orally active selective estrogen receptor modulator with a fixed ring structure similar to raloxifene. Arzoxifene has minimal side effects with powerful antiestrogenic effects on breast cancer and endometrium, with equally strong favorable estrogenic effects on bone and lipid profile[1].

  • CAS Number: 182133-25-1
  • MF: C28H29NO4S
  • MW: 475.59900
  • Catalog: Metabolic Disease
  • Density: 1.234g/cm3
  • Boiling Point: 656.4ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 350.8ºC

MT-3014

MT-3014 is a potent, highly selective and brain-penetrated phosphodiesterase 10A (PDE 10A) inhibitor, with IC50s of 0.062 nM and 0.09 nM for human PDE 10A and bovine PDE 10A, respectively[1].

  • CAS Number: 1332727-40-8
  • MF: C23H25F2N7O
  • MW: 453.49
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ECKOL

Eckol is a potent hMAO-A (Mixed) and hMAO-B (non-competitive) inhibitor with IC50s of 7.20 and 83.44 μM, respectively. Eckol shows stimulatory effects in maize and can be used as a plant biostimulant. Eckol also shows antiallergic and antiviral effects[1][2][3][4].

  • CAS Number: 88798-74-7
  • MF: C18H12O9
  • MW: 372.28200
  • Catalog: Influenza Virus
  • Density: 1.778g/cm3
  • Boiling Point: 685.5ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 368.4ºC

Polyphyllin II

Polyphyllin II is one of the most significant saponins in Rhizoma Paridis and has toxic effects on kinds of cancer cells. Polyphyllin II induces apoptosis through caspases activation and cell-cycle arrest[1].

  • CAS Number: 76296-72-5
  • MF: C44H70O16
  • MW: 871.016
  • Catalog: Apoptosis
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Calicheamicin

Calicheamicin is a cytotoxic agent that causes double-strand DNA breaks.

  • CAS Number: 108212-75-5
  • MF: C55H74IN3O21S4
  • MW: 1368.348
  • Catalog: ADC Cytotoxin
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

3-Methoxy-2-phenyl-4H-chromen-4-one

3-Methoxyflavone is a flavonoid compound isolated from Artemisia incanescens with antiviral activity[1][2].

  • CAS Number: 7245-02-5
  • MF: C16H12O3
  • MW: 252.26
  • Catalog: Infection
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 408.4±45.0 °C at 760 mmHg
  • Melting Point: 114-115ºC (dec.)(lit.)
  • Flash Point: 192.4±15.1 °C

16:0-18:0-16:0 TG-d5

16:0-18:0-16:0 TG-d5 is deuterium labeled 16:0-18:0-16:0 TG.

  • CAS Number: 944709-25-5
  • MF: C53H97D5O6
  • MW: 840.40
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Methyl 2-[(1,1-dioxo-1-thiolan-3-yl)amino]acetate hydrochloride

Methyl N-(1,1-dioxidotetrahydro-3-thienyl)glycinate hydrochloride is a Glycine (HY-Y0966) derivative[1].

  • CAS Number: 1177292-41-9
  • MF: C7H14ClNO4S
  • MW: 243.70800
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

1-Bromoundecane-d3

1-Bromoundecane-d3 is the deuterium labeled 1-Bromoundecane[1].

  • CAS Number: 1219805-63-6
  • MF: C11H23Br
  • MW: 235.204
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 259.1±3.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 105.0±10.0 °C

GABAA receptor agent 4

GABAA receptor agent 4 (compound 1e) is a potent γ-GABAAR antagonist with an Ki of 0.18 µM. GABAA receptor agent 4 efficiently rescues inhibition of T cell proliferation. GABAA receptor agent 4 has the immunomodulatory potential[1].

  • CAS Number: 2035203-91-7
  • MF: C17H24N2O
  • MW: 272.39
  • Catalog: GABA Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Clodronic Acid

Clodronic acid is an orally active bisphosphonate, which is used for researching osteoporosis and diseases associated with excessive bone resorption. Clodronic acid inhibits bone resorption through induction of osteoclast apoptosis. Clodronic acid is effective in the maintenance or improvement of bone mineral density[1].

  • CAS Number: 10596-23-3
  • MF: CH4Cl2O6P2
  • MW: 244.892
  • Catalog: Others
  • Density: 2.3±0.1 g/cm3
  • Boiling Point: 474.7±55.0 °C at 760 mmHg
  • Melting Point: 249-251°
  • Flash Point: 240.9±31.5 °C

9H-Purine, 9-(2-deoxy-b-D-erythro-pentofuranosyl)-6-methyl-

(2R,3S,5R)-2-(hydroxymethyl)-5-(6-methyl-9H-purin-9-yl)tetrahydrofuran-3-ol (9-(2-Deoxy-beta-D-ribofuranosyl)-6-methylpurine) 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: 16006-64-7
  • MF: C12H15N3O3
  • MW: 249.27
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: 1.67g/cm3
  • Boiling Point: 544.7ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 283.2ºC

(R)-(-)-1,2-Propanediol

(R)-(-)-1,2-Propanediol is a (R)-enantiomer of 1,2-Propanediol that produced from glucose in Escherichia coli expressing NADH-linked glycerol dehydrogenase genes[1].

  • CAS Number: 4254-14-2
  • MF: C3H8O2
  • MW: 76.094
  • Catalog: Metabolic Disease
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 184.8±8.0 °C at 760 mmHg
  • Melting Point: -57ºC
  • Flash Point: 107.2±0.0 °C

BTK-IN-14

BTK-IN-14 is a potent inhibitor of BTK. BTK plays an important role in signaling mediated by B cell antigen receptor (BCR) and Fcγreceptor (FcγR) in B cells and myeloid cells, respectively. BTK-IN-14 has the potential for the research of related diseases, especially autoimmune diseases, inflammatory diseases or cancer (extracted from patent WO2022057894A1, compound 1)[1].

  • CAS Number: 2764674-60-2
  • MF: C38H44N8O4
  • MW: 676.81
  • Catalog: Btk
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Xanthone

Xanthone is isolated from Mangosteen and is known to control cell division and growth, apoptosis, inflammation, and metastasis in different stages of carcinogenesis. Xanthone has anti-oxidant, anti-tumor, anti-allergic, anti-inflammatory, anti-bacterial, anti-fungal, and anti-viral activities[1].

  • CAS Number: 90-47-1
  • MF: C13H8O2
  • MW: 196.201
  • Catalog: Apoptosis
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 350.0±12.0 °C at 760 mmHg
  • Melting Point: 172-174 °C(lit.)
  • Flash Point: 169.8±13.1 °C

SCH79797

SCH79797 is a highly potent, selective nonpeptide protease activated receptor 1 (PAR1) antagonist. SCH79797 inhibits binding of a high-affinity thrombin receptor-activating peptide to PAR1 with an IC50 of 70 nM and a Ki of 35 nM. SCH79797 inhibits thrombin-induced platelet aggregation with an IC50 of 3 μM. SCH79797 has antiproliferative and pro-apoptotic effects, and limits myocardial ischemia/reperfusion injury in rat hearts. SCH79797 also potently prevents PAR1 activation in vascular smooth muscle cells, endothelial cells, and astrocytes[1][2][3][4].

  • CAS Number: 245520-69-8
  • MF: C23H25N5
  • MW: 371.48
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: 678.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 364ºC

FEN1-IN-3

FEN1-IN-3 (Compound 4) is a human flap endonuclease-1 (hFEN1) inhibitor. FEN1-IN-3 stabilizes hFEN1 with an EC50 of 6.8 μM[1].

  • CAS Number: 2109805-87-8
  • MF: C15H12N2O4
  • MW: 284.27
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2-((tert-Butoxycarbonyl)amino)-3-(4-chlorophenyl)propanoic acid

2-((tert-Butoxycarbonyl)amino)-3-(4-chlorophenyl)propanoic acid is a phenylalanine derivative[1].

  • CAS Number: 51301-86-1
  • MF: C14H18ClNO4
  • MW: 299.75000
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Mca-Pro-Leu-OH

Mca-Pro-Leu is a tripeptide[1].

  • CAS Number: 140430-55-3
  • MF: C23H28N2O7
  • MW: 444.48
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CORTICOSTATIN RABBIT)

Defensin NP-3A (NP-3A; Corticostatin 1) is a human granulocyte peptide, with anti-ACTH activity. Defensins are antimicrobial peptides with and cytotoxic activity[1][2].

  • CAS Number: 88402-03-3
  • MF: C163H265N63O44S6
  • MW:
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

5-FAM-LL-37

5-FAM-LL-37 is afluorescent labeled LL-37, human (HY-P1222).

  • CAS Number: 2243219-81-8
  • MF: C226H350N60O59
  • MW: 4851.56
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A