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

K 01-162

K 01-162 (K162) binds and destabilizes AβO (β-amyloid), with an EC50 of 80 nM. IC50 value: 80 nM (EC50)Target: Amyloid-βin vitro: The active drug candidate K162 (EC50 = 0.080 μM), stabilizes hydrophobic core I of Aβ42 peptide (residues 17-21) to its α-helical conformation by interacting specifically in this region. [1] K01-162 shows full MC65 protection at 125 nM, an EC50 of 80 nM, and no cytotoxicity up to 50 μM. [2]in vivo:K01-162 can reduce the brain amyloid burden that exists in both fibrillar and RIPA-soluble, non-fibrillar forms.[2]

  • CAS Number: 677746-25-7
  • MF: C15H14BrN
  • MW: 288.18200
  • Catalog: Amyloid-β
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Bruceoside A

Bruceoside A, an abundant quassinoid glycoside in Fructus Bruceae, possesses anti-cancer activity[1].

  • CAS Number: 63306-30-9
  • MF: C32H42O16
  • MW: 682.66600
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Iohexol

Iohexol is a contrast agent.Target: OthersIohexol is a contrast agent. The osmolality of iohexol ranges from 322 mOsm/kg-approximately 1.1 times that of blood plasma-to 844 mOsm/kg, almost three times that of blood. Despite this difference, iohexol is still considered a low-osmolality contrast agent; the osmolality of older agents, such as diatrizoate, may be more than twice as high. From Wikipedia.

  • CAS Number: 66108-95-0
  • MF: C19H26I3N3O9
  • MW: 821.138
  • Catalog: Autophagy
  • Density: 2.2±0.1 g/cm3
  • Boiling Point: 891.5±65.0 °C at 760 mmHg
  • Melting Point: 254-2560C
  • Flash Point: 493.0±34.3 °C

NEP-In-1

NEP-IN-1 is a neutral endopeptidase (NEP) inhibitor with IC50 of 2 nM for dNEP.

  • CAS Number: 465527-94-0
  • MF: C21H30ClNO4
  • MW: 395.92
  • Catalog: Neprilysin
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Atorvastatin Acetonide

Atorvastatin acetonide is an impurity of Atorvastatin, and extracted from patent WO2011131605A1, Compound 4. Atorvastatin is an orally active HMG-CoA reductase inhibitor and has the ability to effectively decrease blood lipids[1].

  • CAS Number: 581772-29-4
  • MF: C36H39FN2O5
  • MW: 598.70400
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ginsenoside Rb2

Ginsenoside Rb2 is one of the main bioactive components of ginseng extracts. Rb2 can upregulate GPR120 gene expression.

  • CAS Number: 11021-13-9
  • MF: C53H90O22
  • MW: 1079.269
  • Catalog: GPR120
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 1117.1±65.0 °C at 760 mmHg
  • Melting Point: 197-199ºC
  • Flash Point: 629.4±34.3 °C

Uty HY Peptide 246-254

Uty HY Peptide (246-254), derived from the ubiquitously transcribed tetratricopeptide repeat gene on the Y chromosome (UTY) protein as an H-Y epitope, H-YDb, is a male-specific transplantation antigen H-Y[1].

  • CAS Number: 261172-28-5
  • MF: C53H77N15O13S2
  • MW: 1196.40000
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Tipranavir-d4

Tipranavir-d4 (PNU-140690-d4) is the deuterium labeled Tipranavir. Tipranavir (PNU-140690) inhibits the enzymatic activity and dimerization of HIV-1 protease, exerts potent activity against multi-protease inhibitor (PI)-resistant HIV-1 isolates with IC50s of 66-410 nM[1][2]. Tipranavir inhibits SARS-CoV-2 3CLpro activity[3].

  • CAS Number: 1217819-15-2
  • MF: C31H33F3N2O5S
  • MW: 602.664
  • Catalog: HIV
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 712.3±70.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 384.6±35.7 °C

(±)-trans-Nerolidol

trans-Nerolidol is a sesquiterpene alcohol. It can be isolated from f aerial parts of Warionia saharae ex Benth. trans-Nerolidol improves the anti-proliferative effect of Doxorubicin (HY-15142A) against intestinal cancer cells in vitro. trans-Nerolidol also has anti-fungal activity[1][2].

  • CAS Number: 40716-66-3
  • MF: C15H26O
  • MW: 222.366
  • Catalog: Fungal
  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 276.0±0.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 96.1±0.0 °C

stephavanine

Stephavanine is a compound isolated from the roots of Stephania abyssinica[1].

  • CAS Number: 33116-33-5
  • MF: C26H27NO9
  • MW: 497.494
  • Catalog: Others
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 702.1±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 378.4±32.9 °C

(2,46-TRI-TERT-BUTYLPHENOXY)DIMETHYLCHLOROSILANE

N-(2,4-Dichlorobenzoyl)glycine is a Glycine (HY-Y0966) derivative[1].

  • CAS Number: 7554-79-2
  • MF: C9H7Cl2NO3
  • MW: 248.06300
  • Catalog: Others
  • Density: 1.505g/cm3
  • Boiling Point: 438.1ºC at 760 mmHg
  • Melting Point: 156-160ºC
  • Flash Point: 218.7ºC

5-Aza-7-deazaguanine

5-Aza-7-deazaguanine is a substrate for wild-type (WT) E. coli purine nucleoside phosphorylase and its Ser90Ala mutant in the synthesis of base-modified nucleosides[1].

  • CAS Number: 67410-64-4
  • MF: C5H5N5O
  • MW: 151.12600
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BAY 2416964

AHR antagonist 3 is a 2-heteroaryl-3-oxo-2,3-dihydropyridazine-4-carboxamide compound and an aryl hydrocarbon receptor (AHR) antagonist extracted from patent WO2018146010A1, example 192, has an IC50 of 341 nM. AHR antagonist 3 has anti-cancer effects[1].

  • CAS Number: 2242464-44-2
  • MF: C18H18ClN5O3
  • MW: 387.82
  • Catalog: Aryl Hydrocarbon Receptor
  • Density: 1.42±0.1 g/cm3(Predicted)
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Boc-NH-PEG1-CH2CH2COOH

Boc-NH-PEG1-CH2CH2COOH is a cleavable (1 unit PEG) ADC linker and also a PEG- and Alkyl/ether-based PROTAC linker can be used in the synthesis of antibody-drug conjugates (ADCs) or PROTACs[1][2].

  • CAS Number: 1260092-44-1
  • MF: C10H19NO5
  • MW: 233.262
  • Catalog: ADC Linker
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 385.0±27.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 186.7±23.7 °C

Maresin 2

Maresin 2 is an anti-inflammatory and pro-resolving mediator from human macrophages. Maresins are a new family of anti-inflammatory and pro-resolving lipid mediators biosynthesized from docosahexaenoic acid (DHA) by macrophages[1].

  • CAS Number: 1639809-46-3
  • MF: C22H32O4
  • MW: 360.487
  • Catalog: Inflammation/Immunology
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 559.4±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 306.2±26.6 °C

NSC 190686-d3

NSC 190686-d3 is the deuterium labeled NSC 190686[1].

  • CAS Number: 1219798-70-5
  • MF: C7H4F2O2
  • MW: 158.102
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 257.0±20.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 109.2±21.8 °C

Fmoc-ser-ome

Fmoc-Ser-OMe (Fmoc-L-Ser-OMe) is a hydroxylated L-amino acid protected with a 9-fluorenylmethyloxycarbonyl (Fmoc) group. Fmoc-Ser-OMe involves in chlorophyll–amino acid conjugates synthesis, and acts as a chromo/fluorophores modified protein and emits visible to near-infrared lights efficiently. Fmoc-Ser-OMe glycosylates and produces small mucin-related Olinked glycopeptides, as an alcohol acceptor[1][2].

  • CAS Number: 82911-78-2
  • MF: C19H19NO5
  • MW: 341.358
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 579.4±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 304.2±28.7 °C

Acetylhydrolase-IN-1

Acetylhydrolase-IN-1 is a 1-Alkyl-2-acetylglycerophosphocholine esterase (Alkylacetyl-GPC: acetylhydrolase) inhibtor.

  • CAS Number: 79637-91-5
  • MF: C23H48NO7P
  • MW: 481.60
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Fluorescent Red Mega 480

Fluorescent Red Mega 480 is a dye that is specifically designed for multicolor techniques. Fluorescent Red Mega 480 is characterized by an extremely large stoke′s shift between excitation and emission maxima[1].

  • CAS Number: 540528-00-5
  • MF: C26H30N2O7S
  • MW: 514.59100
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

IACS-52825

IACS-52825 is a potent and selective DLK inhibitor with Kd of 1.3 nM, useful for the study of chemotherapy-induced peripheral neuropathy[1].

  • CAS Number: 2640376-72-1
  • MF: C16H13F7N4O2
  • MW: 426.29
  • Catalog: MAP3K
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cirsimarin

Cirsimarin is a potent antilipogenic flavonoid isolated from Microtea debilis. Cirsimarin exerts potent antilipogenic effect and decreases adipose tissue deposition in mice. The lipolytic activity of Cirsimarin resulting from both its antagonist activity on adenosin A1 receptor and its inhibitory effect on phosphodiesterase[1].

  • CAS Number: 13020-19-4
  • MF: C23H24O11
  • MW: 476.43000
  • Catalog: Phosphodiesterase (PDE)
  • Density: 1.523g/cm3
  • Boiling Point: 767.1ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 265.8ºC

Barpisoflavone A

Barpisoflavone A is a natural product from Apios americana[1].

  • CAS Number: 101691-27-4
  • MF: C16H12O6
  • MW: 300.263
  • Catalog: Others
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 625.2±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 239.4±25.0 °C

(E)-4-Hydroxytamoxifen

(E)-4-Hydroxytamoxifen, the less active isomer of (Z)-4-hydroxytamoxifen, is an estrogen receptor modulator.

  • CAS Number: 174592-47-3
  • MF: C26H29NO2
  • MW: 387.51400
  • Catalog: Cancer
  • Density: 1.092g/cm3
  • Boiling Point: 514.4ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 264.9ºC

7-(4-Methoxybenzylamino)-4-nitrobenzoxadiazole

MBD (7-(p-Methoxybenzylamino)-4-nitrobenz-2,1,3-oxadiazole), a new fluorescent probe for protein and nucleoprotein conformation, is applied to bacterial ribosomes and to bovine trypsinogen and trypsin. MBD is strongly fluorescent upon binding to a hydrophobic area of a macromolecule[1][2].

  • CAS Number: 33984-50-8
  • MF: C14H12N4O4
  • MW: 300.26900
  • Catalog: Others
  • Density: 1.438 g/cm3
  • Boiling Point: 500.8ºC at 760 mmHg
  • Melting Point: 178-182ºC
  • Flash Point: 256.7ºC

5-Methyl-2-furaldehyde

5-​Methylfurfural is a naturally occurring substance, found in cigarette smoke condensate, licorice essential oil, stored dehydrated orange powder, baked potato flour, volatile compounds of roast beef, aroma concentrate of sponge cake. bread and in coffee, tea and cocoa[1]. A flavoring agent.

  • CAS Number: 620-02-0
  • MF: C6H6O2
  • MW: 110.111
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 187.0±0.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 72.8±0.0 °C

UNC7938

UNC10217938A is a 3-deazapteridine analog with strong oligonucleotide enhancing effects. UNC10217938A enhances oligonucleotides effects by modulating their intracellular trafficking and release from endosomes. UNC10217938A also enhances the effects of antisense and siRNA oligonucleotides[1].

  • CAS Number: 1347749-97-6
  • MF: C26H28N6O2
  • MW: 456.54
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CWI1-2 hydrochloride

CWI1-2 hydrochloride is an IGF2BP2 inhibitor that binds IGF2BP2 and inhibits its interaction with m6A-modified target transcripts, induces apoptosis and differentiation, and shows promising anti-leukemic effects[1].

  • CAS Number: 2408590-37-2
  • MF: C22H18Cl4N6O3
  • MW: 556.23
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Stevioside

Stevioside is a natural sweetener extracted from leaves of Stevia rebaudiana, with anticancer activity[1].

  • CAS Number: 57817-89-7
  • MF: C38H60O18
  • MW: 804.872
  • Catalog: Cancer
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 963.3±65.0 °C at 760 mmHg
  • Melting Point: 198°C
  • Flash Point: 290.3±27.8 °C

HAV 3C proteinase-IN-1

HAV 3C proteinase-IN-1 is a inhibitor of Hepatitis A virus 3C proteinase.

  • CAS Number: 1626408-58-9
  • MF: C26H14N2O3
  • MW: 402.40
  • Catalog: Infection
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CBR-6672

CBR-6672 is a mycobacterium tuberculosis (Mtb) type II NADH dehydrogenase inhibitor, with the MIC of 0.14 μM against Mtb[1].

  • CAS Number: 2225885-40-3
  • MF: C17H20FN3O2S
  • MW: 349.42
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A