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

Arctigenin 4'-O-beta-gentiobioside

Arctigenin 4'-O-β-gentiobioside is a natural compound isolated from Arctigenin.

  • CAS Number: 41682-24-0
  • MF: C33H44O16
  • MW: 696.693
  • Catalog: Others
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 926.1±65.0 °C at 760 mmHg
  • Melting Point: 174-176 °C
  • Flash Point: 291.0±27.8 °C

Tannic acid

Tannic acid is a novel hERG channel blocker with IC50 of 3.4 μM.

  • CAS Number: 1401-55-4
  • MF: C76H52O46
  • MW: 1701.198
  • Catalog: Potassium Channel
  • Density: 2.1±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 218 °C(lit.)
  • Flash Point: 198°C

succinylsulfathiazole

Succinylsulfathiazole is a sulfonamide, it is an ultra long acting drug.

  • CAS Number: 116-43-8
  • MF: C13H13N3O5S2
  • MW: 355.389
  • Catalog: Bacterial
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 187 - 193ºC
  • Flash Point: N/A

Bis-Tos-PEG6

Bis-Tos-PEG6 is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 42749-27-9
  • MF: C26H38O11S2
  • MW: 590.70300
  • Catalog: PROTAC Linker
  • Density: 1.24g/cm3
  • Boiling Point: 687.4ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 369.5ºC

D-(-)-2,5-Dihydrophenylglycine

(R)-2-amino-2-(cyclohexa-1,4-dien-1-yl)acetic acid is a Glycine (HY-Y0966) derivative[1].

  • CAS Number: 26774-88-9
  • MF: C8H11NO2
  • MW: 153.178
  • Catalog: Others
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 342.1±42.0 °C at 760 mmHg
  • Melting Point: 280ºC (dec.)
  • Flash Point: 160.7±27.9 °C

B-HT 920

B-HT 920(Talipexole 2Hcl) is a dopamine D2 receptor agonist, α2-adrenoceptor agonist and 5-HT3 receptor antagonist, which displays antiParkinsonian activity.IC50 Value: 25 nM(Adrenergic receptor α-2, rat)Target: Adrenergic Receptor; 5-HT Receptor; Dopamine Receptorin vitro: N/Ain vivo: Intravenous injection of 30 micrograms/kg of B-HT 920 into cats lead initially to an increase in blood pressure and then to a long-lasting decrease in blood pressure and heart rate. Vagally mediated reflex bradycardia elicited by angiotensin injection in beta-adrenoceptor-blocked dogs was facilitated by intracisternal injection of 10 micrograms/kg B-HT 920.

  • CAS Number: 36085-73-1
  • MF: C10H17Cl2N3S
  • MW: 282.233
  • Catalog: 5-HT Receptor
  • Density: N/A
  • Boiling Point: 364.6ºC at 760mmHg
  • Melting Point: 245ºC dec.
  • Flash Point: 174.3ºC

DEOXYNARCICLASINE

7-Deoxynarciclasine (compound 2b) can be isolated from Hymenocallis littoralis. 7-Deoxynarciclasine inhibits the cancer cell growth[1].

  • CAS Number: 19622-83-4
  • MF: C14H13NO6
  • MW: 291.26
  • Catalog: Cancer
  • Density: 1.72g/cm3
  • Boiling Point: 677.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 363.6ºC

1-Hydroxycanthin-6-one

1-Hydroxycanthin-6-one is an alkaloid that can be found in Ailanthus giraldii[1].

  • CAS Number: 80787-59-3
  • MF: C14H8N2O2
  • MW: 236.225
  • Catalog: Others
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 476.3±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 241.9±28.7 °C

FMOC-L-4-Fluorophe

Fmoc-Phe(4-F)-OH is a phenylalanine derivative[1].

  • CAS Number: 169243-86-1
  • MF: C24H20FNO4
  • MW: 405.418
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 623.9±55.0 °C at 760 mmHg
  • Melting Point: 188ºC
  • Flash Point: 331.1±31.5 °C

Rosiptor

Rosiptor is an activator of SH2-containing inositol-5'-phosphatase 1 (SHIP1).

  • CAS Number: 782487-28-9
  • MF: C20H35NO2
  • MW: 321.497
  • Catalog: Phosphatase
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 451.6±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 226.9±28.7 °C

Olinvacimab

Olinvacimab (TTAC-0001) is a fully human anti-VEGFR2 monoclonal antibody. Olinvacimab inhibits VEGF binds to KDR with a Kd value of 0.23 nM. Olinvacimab has antiangiogenic activity. Olinvacimab can be used for the research of recurrent glioblastoma and breast cancer[1].

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

TY-51469

TY-51469 is a chymase inhibitor with IC50s for simian and human chymases of 0.4 and 7.0 nM, respectively.

  • CAS Number: 603987-59-3
  • MF: C20H15FN2O6S4
  • MW: 526.60
  • Catalog: Inflammation/Immunology
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

S-Allyl-L-cysteine

S-Allyl-L-cysteine, one of the organosulfur compounds found in AGE, possess various biological effects including neurotrophic activity, anti-cancer activity, anti-inflammatory activity.

  • CAS Number: 21593-77-1
  • MF: C6H11NO2S
  • MW: 161.222
  • Catalog: Others
  • Density: 1.191
  • Boiling Point: 300 ºC
  • Melting Point: 235-236 ºC
  • Flash Point: 135 ºC

Olcegepant

Olcegepant is a potent and selective non-peptide antagonist of the calcitonin gene-related peptide 1 (CGRP1) receptor with IC50 of 0.03 nM and Ki of 14.4 pM for human CGRP.

  • CAS Number: 204697-65-4
  • MF: C38H47Br2N9O5
  • MW: 869.64500
  • Catalog: CGRP Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Fomepizole

Fomepizole is a competitive inhibitor of the enzyme alcohol dehydrogenase which plays a key role in the metabolism of ethylene glycol and methanol.

  • CAS Number: 7554-65-6
  • MF: C4H6N2
  • MW: 82.104
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 243.6±0.0 °C at 760 mmHg
  • Melting Point: 13°C
  • Flash Point: 96.1±0.0 °C

TGN-020 sodium

TGN-020 sodium is a selective Aquaporin 4 (AQP4) inhibitor with an IC50 of 3.1 μM[1][2]. TGN-020 sodium is an alkyl chain-based PROTAC linker that can be used in the synthesis of PROTACs[3]. TGN-020 sodium alleviates edema and inhibits glial scar formation after spinal cord compression injury in rats[4].

  • CAS Number: 1313731-99-5
  • MF: C8H5N4NaOS
  • MW: 228.21
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Dihydrokavain

Dihydrokavain is one of the six major kavalactones found in the kava plant; appears to contribute significantly to the anxiolytic effects of kava, based on a study in chicks.

  • CAS Number: 587-63-3
  • MF: C14H16O3
  • MW: 232.275
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 413.6±45.0 °C at 760 mmHg
  • Melting Point: 56-60ºC
  • Flash Point: 175.6±23.3 °C

Neuropeptide EI (human, mouse, rat) trifluoroacetate salt

Neuropeptide EI, rat displays functional melanin concentrating hormone (MCH)-antagonist and melanocyte-stimulating hormone (MSH) agonist activity in different behavioral paradigms[1].

  • CAS Number: 125934-45-4
  • MF: C63H98N16O23
  • MW: 1447.55000
  • Catalog: MCHR1 (GPR24)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Tetrazine-Ph-NHCO-C3-NHS ester

Tetrazine-Ph-NHCO-C3-NHS ester is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 1244040-64-9
  • MF: C18H18N6O5
  • MW: 398.37300
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-2-(Hydroxyethyl)-L-valine-d4

N-2-(Hydroxyethyl)-L-valine-d4 is the deuterium labeled N-2-(Hydroxyethyl)-L-valine[1].

  • CAS Number: 120398-50-7
  • MF: C7H11D4NO3
  • MW: 165.22400
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(15R)-12-Hydroxy-15-methyllycopodan-5-one

Lycodoline is a alkaloid with butyrylcholinesterase (BChE) (IC50 of 667 μM) inhibition activities[1].

  • CAS Number: 6900-92-1
  • MF: C16H25NO2
  • MW: 263.375
  • Catalog: Neurological Disease
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 412.7±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 203.4±28.7 °C

Ralimetinib

Ralimetinib (LY2228820) is a potent and selective, ATP-competitive inhibitor of p38 MAPK α/β, with IC50s of 5.3 and 3.2 nM, respectively. Ralimetinib (LY2228820) selectively inhibits phosphorylation of MK2 (Thr334), with no effect on phosphorylation of p38α MAPK, JNK, ERK1/2, c-Jun, ATF2, or c-Myc[1].

  • CAS Number: 862505-00-8
  • MF: C24H29FN6
  • MW: 420.53
  • Catalog: p38 MAPK
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 634.4±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 337.5±34.3 °C

Flavopiridol

Flavopiridol is a broad spectrum and competitive inhibitor of CDKs, inhibiting CDK1, CDK2, CDK4 with IC50s of 30, 170, 100 nM, respectively.

  • CAS Number: 146426-40-6
  • MF: C21H20ClNO5
  • MW: 401.840
  • Catalog: Autophagy
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 603.6±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 318.8±31.5 °C

Dibutyl sebacate

Dibutyl sebacate (Dibutyl decanedioate) is a dibutyl ester of sebacic acid, mainly used as a plasticizer in production of plastics[1].

  • CAS Number: 109-43-3
  • MF: C18H34O4
  • MW: 314.460
  • Catalog: Others
  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 351.3±10.0 °C at 760 mmHg
  • Melting Point: 205 °C (dec.)(lit.)
  • Flash Point: 157.5±17.4 °C

dinutuximab

Dinutuximab (Unituxin; APN-311) is a chimeric, human-murine, anti-GD2 monoclonal antibody. Dinutuximab potently enlongs event-free survival and overall survival, in high-risk neuroblastoma treatment, in combination with granulocyte-macrophage colony-stimulating factor (GM-CSF), aldesleukin (interleukin-2 [IL-2]), and isotretinoin (13-cis-retinoic acid [RA])[1].

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

4-Pentyl(O-2H5)phenol

4-Pentylphenol-d5 is the deuterium labeled 4-Pentylphenol[1].

  • CAS Number: 126839-95-0
  • MF: C11H11D5O
  • MW: 169.275
  • Catalog: Others
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 250.5±0.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 135.0±8.8 °C

DAPOA

DAPOA is a click chemistry reagent containing an azide group. DAPOA can be used in peptide synthesis as a linker that can be further modified at the azido-groups using Staudinger ligation or click-chemistry[1].

  • CAS Number: 2389064-43-9
  • MF: C5H8N6O3
  • MW: 200.16
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Avanafil

Avanafil(TA-1790) is a potent and highly selective phosphodiesterase-5(PDE-5) inhibitor(IC50=5.2 nM) for erectile dysfunction; lower selectivity against PDE1, PDE6, and PDE11.IC50 value: 5.2 nM [1]Target: PDE5Avanafil is highly selective toward PDE5 and against all other PDE isozymes tested. Lower selectivity against PDE1, PDE6, and PDE11 is consistent with results from randomized, placebo-controlled, phase 3 trials in which musculoskeletal and hemodynamic adverse events were reported in <2% of patients and no color vision-related abnormalities were reported with avanafil doses up to 200mg once daily [2]. Intraduodenal doses of avanafil or sildenafil (0.1 and 1 mg/kg) potentiated the AUC of nitroglycerin induced hypotension. However, the potentiating effect of avanafil at 1 mg/kg was significantly weaker than that of sildenafil (p <0.05) [3].

  • CAS Number: 330784-47-9
  • MF: C23H26ClN7O3
  • MW: 483.951
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 150-152ºC
  • Flash Point: N/A

Triclopyricarb

Triclopyricarb (SYP-7017) is a strobilurin fungicide that can be used in crops disease control. Triclopyricarb inhibits mycelial growth with EC50 values ranged from 0.006 µg/mL to 0.047 µg/mL[1][2].

  • CAS Number: 902760-40-1
  • MF: C15H13Cl3N2O4
  • MW: 391.63400
  • Catalog: Fungal
  • Density: N/A
  • Boiling Point: 450.5±55.0 °C(Predicted)
  • Melting Point: N/A
  • Flash Point: N/A

Tetrachloroveratrole

Tetrachloroveratrole is one of the biodegradation products of bacterial O-methylation of Tri- and Tetra chloroguaiacols. The Tri- and Tetra chloroguaiacols are formed during bleaching of wood pulp in the paper manufacturing industry[1].

  • CAS Number: 944-61-6
  • MF: C8H6Cl4O2
  • MW: 275.94400
  • Catalog: Others
  • Density: 1.489g/cm3
  • Boiling Point: 318.5ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 122.1ºC