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

L-Histidine, N-formyl-

N-Formyl-L-histidine shows binding affinity to histidyl-tRNA synthetase with a Ki value of 4.6 μM. N-Formyl-L-histidine shows a competitive inhibition against L-histidine ammonia-lyase, inhibits urocanic acid formation from L-histidine with a Ki value of 4.26 mM[1][2].

  • CAS Number: 15191-21-6
  • MF: C7H9N3O3
  • MW: 183.16500
  • Catalog: Others
  • Density: 1.51g/cm3
  • Boiling Point: 442.9ºC at 760mmHg
  • Melting Point: 202.0 to 206.0 °C
  • Flash Point: 221.6ºC

MW-150 hydrochloride

MW-150 hydrochloride (MW01-18-150SRM hydrochloride) is a selective inhibitor of p38αMAPK isoform with a ki of 101 nM[1].

  • CAS Number: 1923773-01-6
  • MF: C24H24ClN5
  • MW: 417.93
  • Catalog: p38 MAPK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ro 23-7637

Ro 23-7637 is an orally active, efficacious antiobesity agent[1].

  • CAS Number: 107071-66-9
  • MF: C33H40N2O
  • MW: 480.68400
  • Catalog: Metabolic Disease
  • Density: 1.085g/cm3
  • Boiling Point: 659.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 352.5ºC

4-(2,5-dioxo-2H-pyrrol-1(5H)-yl)butanoic acid

4-Maleimidobutyric acid is an alkyl chain-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 57078-98-5
  • MF: C8H9NO4
  • MW: 183.161
  • Catalog: PROTAC Linker
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 400.1±28.0 °C at 760 mmHg
  • Melting Point: 95-98ºC
  • Flash Point: 195.8±24.0 °C

Ducheside A

Ducheside A is a ellagic glycoside that can be found in Ducheside indica Focke[1].

  • CAS Number: 176665-78-4
  • MF: C20H16O12
  • MW: 448.33
  • Catalog: Others
  • Density: 1.9±0.1 g/cm3
  • Boiling Point: 879.8±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 315.3±27.8 °C

iKIX1

A small-molecule inhibitor of the interaction of the C. glabrata Pdr1 activation domain with the C. glabrata Gal11A KIX domain with Ki of 18 uM; blocks Gal11/Med15 recruitment and inhibits Pdr1-dependent gene activation and re-sensitizes drug-resistant C. glabrata to azole antifungals in vitro and in animal models for disseminated and urinary tract C. glabrata infection; a novel therapeutic strategy in fungal infectious disease.

  • CAS Number: 656222-54-7
  • MF: C10H8Cl2N4OS
  • MW: 303.168
  • Catalog: Fungal
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

5-Fluorouracil-13C,15N2

5-Fluorouracil-13C,15N2 is the 13C and 15N labeled 5-Fluorouracil[1]. 5-Fluorouracil (5-FU) is an analogue of uracil and a potent antitumor agent. 5-Fluorouracil affects pyrimidine synthesis by inhibiting thymidylate synthetase thus depleting intracellular dTTP pools. 5-Fluorouracil induces apoptosis and can be used as a chemical sensitizer[2][3]. 5-Fluorouracil also inhibits HIV[4].

  • CAS Number: 1189423-58-2
  • MF: C313CH3F15N2O2
  • MW: 133.057
  • Catalog: HIV
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SARS-CoV-2 Mpro-IN-12

SARS-CoV-2 Mpro-IN-12 (compound D026) is a SARS-CoV-2 main protease (Mpro) inhibitor with antiviral activities[1].

  • CAS Number: 370583-15-6
  • MF: C20H17NO3
  • MW: 319.35
  • Catalog: SARS-CoV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Irbesartan D4

Irbesartan D4 is the deuterium labeled Irbesartan, which is a highly potent and specific angiotensin II type 1 (AT1) receptor antagonist.

  • CAS Number: 1216883-23-6
  • MF: C25H24D4N6O
  • MW: 432.55400
  • Catalog: Angiotensin Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

LDHA/PDKs-IN-2

LDHA/PDKs-IN-2 (compound 20k) is a potent and dual inhibitor of PDKs and LDHA with IC50s of 1.6 and 0.7 μM, respectively. LDHA/PDKs-IN-2 reduces A549 cell proliferation with an EC50 of 15.7 μM and decreases the lactate formation, and increases oxygen consumption. LDHA/PDKs-IN-2 has the potential for the research of cancer diseases[1].

  • CAS Number: 2490699-44-8
  • MF: C17H20N2O5
  • MW: 332.35
  • Catalog: PDK-1
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

beta-Rhamnocitrin

Rhamnetin is a quercetin derivative found in Coriandrum sativum, inhibits secretory phospholipase A2, with antioxidant and anti-inflammatory activity[1].

  • CAS Number: 90-19-7
  • MF: C16H12O7
  • MW: 316.26200
  • Catalog: Phospholipase
  • Density: 1.634g/cm3
  • Boiling Point: 627.9ºC at 760 mmHg
  • Melting Point: 293-296°C (dec.)
  • Flash Point: 238.9ºC

4-Oxododecanedioic acid

4-Oxododecanedioic acid is a fatty acid derivative[1].

  • CAS Number: 30828-09-2
  • MF: C12H20O5
  • MW: 244.284
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 472.4±25.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 253.6±19.7 °C

Herbacetin

Herbacetin is a natural flavonoid from flaxseed, exerts various pharmacological activities, including antioxidant, anti-inflammatory and anticancer effects[1]. Herbacetin is an Ornithine decarboxylase (ODC) allosteric inhibitor, directly binds to Asp44, Asp243, and Glu384 on ODC. Ornithine decarboxylase (ODC) is a rate-limiting enzyme in the first step of polyamine biosynthesis[2].

  • CAS Number: 527-95-7
  • MF: C15H10O7
  • MW: 302.236
  • Catalog: Cancer
  • Density: 1.799
  • Boiling Point: 618.7±55.0 °C at 760 mmHg
  • Melting Point: 284ºC
  • Flash Point: 239.0±25.0 °C

Thymine-α,α,α,6-d4 Glycol (mixture of diastereomers)-d4

Thymine-α,α,α,6-d4 Glycol (mixture of diastereomers)-d4 is the deuterium labeled Thymine-α,α,α,6-d4 Glycol (mixture of diastereomers)[1].

  • CAS Number: 132523-94-5
  • MF: C7H6D4N2O4
  • MW: 190.19000
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Doxepin

Doxepin inhibits reuptake of serotonin and norepinephrine as a tricyclic antidepressant. Doxepin has therapeutic effects in atopic dermatitis,chronic urticarial,can improve cognitive processes, protect central nervous system. Doxepin has also been proposed as a protective factor against oxidative stress[1][2][3].

  • CAS Number: 1668-19-5
  • MF: C19H21NO
  • MW: 279.37600
  • Catalog: Akt
  • Density: 1.122 g/cm3
  • Boiling Point: 413.3ºC at 760 mmHg
  • Melting Point: 187-189ºC
  • Flash Point: 121.3ºC

Valsartan

Valsartan (CGP-48933) is an angiotensin II receptor antagonist for treatment of high blood pressure and heart failure.

  • CAS Number: 137862-53-4
  • MF: C24H29N5O3
  • MW: 435.519
  • Catalog: Angiotensin Receptor
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 684.9±65.0 °C at 760 mmHg
  • Melting Point: 116-117°C
  • Flash Point: 368.0±34.3 °C

Phosphorylcholine

Phosphorylcholine is an antigenic cell-surface component found on many commensal and pathogenic bacteria that reside in the upper airway.

  • CAS Number: 107-73-3
  • MF: C5H15ClNO4P
  • MW: 219.604
  • Catalog: Cardiovascular Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

IC 261

IC261 is a selective, ATP-competitive CK1 inhibitor, with IC50s of 1 μM, 1 μM, 16 μM for Ckiδ, Ckiε and Ckiα1, respectively.

  • CAS Number: 186611-52-9
  • MF: C18H17NO4
  • MW: 311.332
  • Catalog: Casein Kinase
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 555.2±50.0 °C at 760 mmHg
  • Melting Point: 214 °C
  • Flash Point: 289.6±30.1 °C
  • CAS Number: 480-82-0
  • MF: C15H25NO5
  • MW: 299.36
  • Catalog: Others
  • Density: 1.26g/cm3
  • Boiling Point: 463.3ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 234ºC

Ecromeximab

Ecromeximab (KM 871; KW 2871) is a mouse-derived IgG-κ chimeric antibody targeting ganglioside GD3. Ecromeximab is expressed by YB2/0 rat hybridoma cells[1].

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

Bacopaside N1

Bacopaside N1 is a diglycosidic saponin[1].

  • CAS Number: 871706-74-0
  • MF: C42H68O14
  • MW: 796.98
  • Catalog: Neurological Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(S)-Boc-b-Iodo-Ala-OMe

(S)-2-[(tert-Butoxycarbonyl)amino]-3-iodopropionic acid methyl ester is an alanine derivative[1].

  • CAS Number: 170848-34-7
  • MF: C9H16INO4
  • MW: 329.132
  • Catalog: Others
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 356.5±32.0 °C at 760 mmHg
  • Melting Point: 55-59ºC
  • Flash Point: 169.4±25.1 °C

3-O-Ethyl-L-ascorbic acid

3-O-Ethyl-L-ascorbic acid, a stable vitamin C derivative, is a cosmetic tyrosinase tnhibitor with a whitening capacity. 3-O-Ethyl-L-ascorbic acid also has antioxidant abilities[1][2].

  • CAS Number: 86404-04-8
  • MF: C8H12O6
  • MW: 204.177
  • Catalog: Tyrosinase
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 551.5±50.0 °C at 760 mmHg
  • Melting Point: 112.0 to 116.0 °C
  • Flash Point: 228.5±23.6 °C

1-[4-hydroxy-3-trityloxy-5-(trityloxymethyl)oxolan-2-yl]pyrimidine-2,4-dione

2',5'-Bis-O-(triphenylMethyl)uridine is a uridine analog. Uridine has potential antiepileptic effects, and its analogs can be used to study anticonvulsant and anxiolytic activities, as well as to develop new antihypertensive agents[1].

  • CAS Number: 6554-11-6
  • MF: C47H40N2O6
  • MW: 728.83
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: 1.33g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Phe-Met-Arg-Phe, amide

Phe-Met-Arg-Phe, amide dose dependently (ED50=23 nM) activates a K+ current in the peptidergic caudodorsal neurons.

  • CAS Number: 64190-70-1
  • MF: C29H42N8O4S
  • MW: 598.76000
  • Catalog: Peptides
  • Density: 1.32 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

testololactone

Testololactone is an aromatase inhibitor. Testololactone can be used for research of breast carcinoma[1].

  • CAS Number: 4416-57-3
  • MF: C19H26O3
  • MW: 302.40800
  • Catalog: Cancer
  • Density: 1.15g/cm3
  • Boiling Point: 478.2ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 211.2ºC

N-Fmoc-L-pipecolic acid

Fmoc-HoPro-OH is a proline derivative[1].

  • CAS Number: 86069-86-5
  • MF: C21H21NO4
  • MW: 351.396
  • Catalog: Others
  • Density: 1.293±0.06 g/cm3
  • Boiling Point: 553.7±50.0 °C at 760 mmHg
  • Melting Point: 161-162.5 ºC
  • Flash Point: 288.7±30.1 °C

Aminooxy-PEG4-t-butyl ester

Aminooxy-PEG4-C2-Boc is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 2100306-82-7
  • MF: C15H31NO7
  • MW: 337.41
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Eftilagimod alfa

Eftilagimod alfa (IMP321) is a recombinant LAG-3Ig fusion protein that binds to MHC class II. Eftilagimod alfa mediates antigen-presenting cell (APC) activation followed by CD8 T-cell activation. Eftilagimod alfa can be used for metastatic melanoma and metastatic breast carcinoma research[1].

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

Rolinsatamab

Rolinsatamab is a potent dual IL-4 and IL-13 inhibitor as a fully humanized bispecific monoclonal antibody. Rolinsatamab chimeric antigen receptor sequence T cell. Rolinsatamab can be used in research of immune disease[1].

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