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

PK11195

PK-11195 is a ligand of translocator protein (TSPO), which targets Leishmania chemotherapy, with IC50s of 14.2 μM, 8.2 μM, 3.5 μM for L. amazonensis, L. major and L. braziliensis, respectively.

  • CAS Number: 85532-75-8
  • MF: C21H21ClN2O
  • MW: 352.857
  • Catalog: Parasite
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 511.7±45.0 °C at 760 mmHg
  • Melting Point: 74-75
  • Flash Point: 263.3±28.7 °C

GT-1

GT-1 (LCB10-0200), a siderophore-linked cephalosporin, is effective against clinical isolates of P. aeruginosa, Klebsiella oxytoca, Proteus spp., Serratia marcescens, and Enterobacter aerogenes.

  • CAS Number: 1401527-90-9
  • MF: C29H30ClN11O11S2
  • MW: 808.20
  • Catalog: Infection
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Mal-PEG2-NH2 TFA

Mal-PEG2-NH2 (TFA) is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 660843-23-2
  • MF: C12H17F3N2O6
  • MW: 342.26800
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Amino-PEG4-C2-amine

Amino-PEG4-C2-amine is a PEG-based (4 units) PROTAC linker can be used in the synthesis of PROTACs.

  • CAS Number: 68960-97-4
  • MF: C10H24N2O4
  • MW: 236.30900
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: 139 °C/0.2 mmHg
  • Melting Point: N/A
  • Flash Point: 157 °C

TLR9-IN-1

TLR9-IN-1 is a potent and selective TLR9 inhibitor with an IC50 value of 7 nM for human TLR9. TLR9-IN-1 can be used for researching diseases associated with undesirable immune response[1].

  • CAS Number: 2226366-86-3
  • MF: C23H31N7O
  • MW: 421.54
  • Catalog: Toll-like Receptor (TLR)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(S)-Donepezil

(S)-Donepezil is a S-enantiomer of Donepezil (HY-14566). Donepezil is a specific and potent AChE inhibitor[1][2].

  • CAS Number: 142057-80-5
  • MF: C24H29NO3
  • MW: 379.49
  • Catalog: AChE
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 527.9±50.0 °C at 760 mmHg
  • Melting Point: 206.72° C
  • Flash Point: 273.1±30.1 °C

Clemaphenol A

Clemaphenol A is a chemical constituent of the flower of Fritillaria pallidiflora[1].

  • CAS Number: 362606-60-8
  • MF: C20H22O6
  • MW: 358.385
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 560.0±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 292.5±30.1 °C

Acetylleucine

Acetylleucine is a drug used in the treatment of vertigo.

  • CAS Number: 99-15-0
  • MF: C8H15NO3
  • MW: 173.210
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 369.6±25.0 °C at 760 mmHg
  • Melting Point: 160ºC
  • Flash Point: 177.4±23.2 °C

H-Gly-Ala-Tyr-OH

Ala-Gly-Tyr is a tripeptide composed of L-alanine, glycine, and L-tyrosine joined in sequence by peptide linkages. Ala-Gly-Tyr has a role as a metabolite. Ala-Gly-Tyr is functionally related to L-alanine, glycine and L-tyrosine.

  • CAS Number: 92327-84-9
  • MF: C14H19N3O5
  • MW: 309.31800
  • Catalog: Others
  • Density: N/A
  • Boiling Point: 705.0±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 380.1±32.9 °C

PF-04957325

PF-04957325 is a highly potent and selective PDE8 inhibitor, with IC50s of 0.7 nM and 0.3 nM for PDE8A and PDE8B, respectively.

  • CAS Number: 1305115-80-3
  • MF: C14H15F3N8OS
  • MW: 400.382
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.8±0.1 g/cm3
  • Boiling Point: 475.4±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 241.3±28.7 °C

Auriculin A

Auriculin A is a synthetic atrial natriuretic factor (ANF) with hemodynamic effect. Auriculin A antagonizes renal vasoconstriction in the dog, and influences on arterial baroreflex control of heart rate, systemic blood pressure, and perfusion pressure in the hind limb (perfused at constant flow) in rabbits[1][2].

  • CAS Number: 91421-87-3
  • MF: C104H168N38O33S2
  • MW: 2542.81000
  • Catalog: Cardiovascular Disease
  • Density: 1.56
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

1-Aminopyrene-d9

1-Pyrenamin-d9 is the deuterium labeled 1-Pyrenamin[1].

  • CAS Number: 128008-86-6
  • MF: C16H2D9N
  • MW: 226.32
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 115-117°C
  • Flash Point: N/A

A 484954

A-484954 is a highly selective eukaryotic elongationfactor-2 (eEF2) inhibitor, with an IC50 of 280 nM.

  • CAS Number: 142557-61-7
  • MF: C13H15N5O3
  • MW: 289.29000
  • Catalog: CaMK
  • Density: 1.522±0.06 g/cm3 (20 ºC 760 Torr)
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

3-(Methylselanyl)-L-alanine hydrochloride (1:1)

Se-Methylselenocysteine hydrochloride, a precursor of Methylselenol, has potent cancer chemopreventive activity and anti-oxidant activity. Se-Methylselenocysteine hydrochloride is orally bioavailable, and induces apoptosis[1][2].

  • CAS Number: 863394-07-4
  • MF: C4H10ClNO2Se
  • MW: 218.54
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Bezlotoxumab

Bezlotoxumab is a human monoclonal antibody directed against C. difficile toxin B. Bezlotoxumab binds to C. difficile toxin B preventing intestinal epithelial damage and colitis[1].

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

Trifluridine-13C,15N2

Trifluridine-13C,15N2 is the 13C and 15N labeled Trifluridine[1]. Trifluridine (Trifluorothymidine;5-Trifluorothymidine;TFT) is an irreversible thymidylate synthase inhibitor, and thereby suppresses DNA synthesis. Trifluridine is an antiviral drug for herpes simplex virus (HSV) infection. Trifluorothymidine also has anti-orthopoxvirus activity[2].

  • CAS Number: 2086328-10-9
  • MF: C913CH11F315N2O5
  • MW: 299.18
  • Catalog: HSV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Bis-propargyl-PEG3

Bis-propargyl-PEG3 is a PEG-based PROTAC linker used in the synthesis of PROTACs. Bis-propargyl-PEG3 is used in the synthesis of zinc-dipicolylamine (ZnDPA) complexes with antiplasmodial activity[1] [2].

  • CAS Number: 126422-58-0
  • MF: C12H18O4
  • MW: 226.26900
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CEF4

CEF4 is a peptide that corresponds to aa 342-351 of the influenza A virus nucleocapsid protein.

  • CAS Number: 199727-68-9
  • MF: C53H93N15O13
  • MW: 1148.40
  • Catalog: Peptides
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

n-acetyl-s-benzyl-dl-cysteine

N-Acetyl-S-benzyl-DL-cysteine is a cysteine derivative[1].

  • CAS Number: 19538-71-7
  • MF: C12H15NO3S
  • MW: 253.31700
  • Catalog: Others
  • Density: 1.246g/cm3
  • Boiling Point: 506.2ºC at 760mmHg
  • Melting Point: 156ºC
  • Flash Point: 259.9ºC

N-(azide-PEG3)-N'-(Mal-PEG4)-Cy5

N-(azide-PEG3)-N'-(Mal-PEG4)-Cy5 is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 2107273-74-3
  • MF: C50H68ClN7O10
  • MW: 962.57
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Coclauril

Coclauril is an inhibitor of HBV. Coclauril inhibits HBV replication in the human hepatoblastoma cell line with an EC50 of 7.6 μg/mL[1].

  • CAS Number: 127350-68-9
  • MF: C8H9NO2
  • MW: 151.16
  • Catalog: HBV
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 392.0±42.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 190.9±27.9 °C

Elafibranor

Elafibranor is a PPARα/δ agonist with EC50s of 45 and 175 nM, respectively.

  • CAS Number: 923978-27-2
  • MF: C22H24O4S
  • MW: 384.489
  • Catalog: PPAR
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 569.0±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 297.9±30.1 °C

Deltasonamide 1

A novel small molecule inhibitor of PDE6δ/KRas interaction with Kd of 203 pM; inhibits PDE6δ/KRas interaction in cells with Kd of 85 nM, selectively inhibits growth of KRas mutated and -dependent cells.

  • CAS Number: 2088485-33-8
  • MF: C30H39ClN6O4S2
  • MW: 647.25
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

fluclorolone acetonide

Flucloronide (Fluclorolone acetonide) is a corticosteroid for topical, and has anti-inflammatory activity[1].

  • CAS Number: 3693-39-8
  • MF: C24H29Cl2FO5
  • MW: 487.38800
  • Catalog: Inflammation/Immunology
  • Density: 1.38g/cm3
  • Boiling Point: 598.3ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 315.6ºC

MLS000544460

MLS000544460 is a highly selective and reversible Eya2 phosphatase inhibitor with a Kd of 2.0 μM and an IC50 of 4 μM. MLS000544460 inhibit Eya2 phosphatase mediated cell migration and has anti-cancer activity[1].

  • CAS Number: 352336-36-8
  • MF: C17H12FN3O2S
  • MW: 341.36
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Delpazolid

Delpazolid is a novel oxazolidinone antibiotic agent which can inhibit the growth of MSSA and MRSA with a MIC90 of 2 μg/mL for both of them.

  • CAS Number: 1219707-39-7
  • MF: C14H17FN4O3
  • MW: 308.308
  • Catalog: Bacterial
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 481.8±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 245.2±31.5 °C

2,6-Difluorophenylalanine

2,6-Difluoro-DL-phenylalanine is a phenylalanine derivative[1].

  • CAS Number: 32133-39-4
  • MF: C9H9F2NO2
  • MW: 201.170
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 301.1±42.0 °C at 760 mmHg
  • Melting Point: 256-257ºC
  • Flash Point: 135.9±27.9 °C

Besifloxacin

Besifloxacin is a fluoroquinolone antimicrobial agent. Besifloxacin can inhibit cytokine production by monocytes. Besifloxacin has broad-spectrum antibacterial activity[1].

  • CAS Number: 141388-76-3
  • MF: C19H21ClFN3O3
  • MW: 393.84
  • Catalog: Bacterial
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 607.0±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 320.9±31.5 °C

Spinosad

Spinosad, a mixture of spinosyns A and D known as fermentation products of a soil actinomycete (Saccharopolyspora spinosa), is a biological neurotoxic insecticide with a broader action spectrum. Spinosad targets the nicotinic acetylcholine receptor (nAChRs) of the insect nervous system. Spinosad has an excellent environmental and mammalian toxicological profile. Larvicidal activity[1][2][3].

  • CAS Number: 168316-95-8
  • MF: C42H71NO9
  • MW: 734.014
  • Catalog: nAChR
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 776.3±60.0 °C at 760 mmHg
  • Melting Point: 84ºC to 99.5ºC
  • Flash Point: 423.3±32.9 °C

Fantofarone

Fantofarone is a highly potent Calcium Channel antagonist.

  • CAS Number: 114432-13-2
  • MF: C31H38N2O5S
  • MW: 550.70900
  • Catalog: Calcium Channel
  • Density: 1.16g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A