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

JH-131e-153

JH-131e-153, a diacylglycerol (DAG)-lactone, is a small molecule activator of Munc13-1, targeting the C1 domain. The activation sequence of JH-131e-153 on Munc13-1 is WT>I590≈R592A≈W588A. The C1 domain of Munc13-1 and protein kinase C (PKC) are homologous in sequence and structure. The activation sequence of JH-131e-153 on Munc13-1 and PKC was PKCα>Munc13-1>PKCε. JH-131e-153 regulates neuronal processes through Munc13-1 and can be further used in the study of neurodegenerative diseases[1].

  • CAS Number: 742104-91-2
  • MF: C22H38O5
  • MW: 382.53
  • Catalog: Neurological Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Dehydroeburicoic acid

Dehydrotrametenolic acid is a sterol isolated from the sclerotium of Poria cocos. Dehydrotrametenolic acid induces apoptosis through caspase-3 pathway. Dehydrotrametenolic acid has anti-tumor activity, anti-inflammatory, anti-diabetic effects[1].

  • CAS Number: 6879-05-6
  • MF: C31H48O3
  • MW: 468.71100
  • Catalog: Caspase
  • Density: 1.07±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

UIAA-II-232

UIAA-II-232 (compound 19b) is a potent DNA gyrase catalytic inhibitor with an IC50 value of 3.5 µM[1].

  • CAS Number: 2428407-03-6
  • MF: C20H24FN5O3
  • MW: 401.43
  • Catalog: DNA/RNA Synthesis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Heraclenol

Heraclenol, a coumarin, is isolated from the fruits of Angelica lucida, and exhibits antibacterial activities[1].

  • CAS Number: 31575-93-6
  • MF: C16H16O6
  • MW: 304.295
  • Catalog: Bacterial
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 544.3±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 283.0±30.1 °C

TRAM-34

TRAM-34 is a highly selective blocker of intermediate-conductance calcium-activated K+ channel (IKCa1) (Kd=20 nM).

  • CAS Number: 289905-88-0
  • MF: C22H17ClN2
  • MW: 344.837
  • Catalog: Potassium Channel
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 510.2±50.0 °C at 760 mmHg
  • Melting Point: 145-147ºC
  • Flash Point: 262.4±30.1 °C

PK 44 phosphate

PK44 phosphate is a potent dipeptidyl peptidase IV (DPP-IV) inhibitor with an IC50 value of 15.8 nM[1].

  • CAS Number: 1017682-66-4
  • MF: C17H16F5N7O•H3PO4
  • MW: 527.34
  • Catalog: Dipeptidyl Peptidase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Gemlapodect

Gemlapodect (RO554965) is an inhibitor of phosphodiesterase 10A (PDE10A). Gemlapodect can be used for researching schizophrenia[1].

  • CAS Number: 1380329-87-2
  • MF: C22H21N7O3
  • MW: 431.45
  • Catalog: Phosphodiesterase (PDE)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Periplocin

Periplocin is a cardiotonic steroid isolated from Periploca forrestii. Periplocin promotes tumor cell apoptosis and inhibits tumor growth. Periplocin has the potential to facilitate wound healing through the activation of Src/ERK and PI3K/Akt pathways mediated by Na/K-ATPase[1][2].

  • CAS Number: 13137-64-9
  • MF: C36H56O13
  • MW: 682.795
  • Catalog: Apoptosis
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 877.4±65.0 °C at 760 mmHg
  • Melting Point: 205°C
  • Flash Point: 272.8±27.8 °C

Sodium diatrizoate

Sodium diatrizoate is an iodinated radiocontrast agent.

  • CAS Number: 737-31-5
  • MF: C11H8I3N2NaO4
  • MW: 635.895
  • Catalog: Others
  • Density: N/A
  • Boiling Point: 614.1ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 325.2ºC

CaMaric acid

Camaric acid can be isolated from the root of Lantana montevidensis and has antibacterial activity[1].

  • CAS Number: 146450-83-1
  • MF: C35H52O6
  • MW: 568.78
  • Catalog: Bacterial
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 654.7±55.0 °C at 760 mmHg
  • Melting Point: 188-189 °C
  • Flash Point: 198.9±25.0 °C

Zinc Undecylenate

10-Undecenoic acid zinc salt is a natural or synthetic fungistatic fatty acid, is used topically in creams against fungal infections, eczemas, ringworm, and other cutaneous conditions. The zinc provides an astringent action.

  • CAS Number: 557-08-4
  • MF: C22H38O4Zn
  • MW: 431.944
  • Catalog: Fungal
  • Density: 1.63g/cm3
  • Boiling Point: 300.8ºC
  • Melting Point: 118-121ºC
  • Flash Point: 145.8ºC

CC-90003

CC-90003 is an irreversible and selective inhibitor of ERK 1/2 with antitumor activity.

  • CAS Number: 1621999-82-3
  • MF: C22H21F3N6O2
  • MW: 458.44
  • Catalog: ERK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-Boc-piperazine

N-Boc-piperazine is a Alkyl/ether-based PROTAC linker that can be used in the synthesis of PROTAC PD-1/PD-L1 degrader-1 (HY-131183)[1].

  • CAS Number: 57260-71-6
  • MF: C9H18N2O2
  • MW: 186.251
  • Catalog: PROTAC Linker
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 258.0±15.0 °C at 760 mmHg
  • Melting Point: 47-49ºC
  • Flash Point: 109.8±20.4 °C

Hematin

Hematin, an iron-containing porphyrin, inhibits the activity of clotting factors and also fibrin clot lysis through the mechanism of binding to and inactivation of hemostatic proteins[1]. Hematin can be used for the research of acute porphyrias and cancer[1][2][3][4][5].

  • CAS Number: 15489-90-4
  • MF: C34H33FeN4O5
  • MW: 633.495
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: 1128.5ºC at 760 mmHg
  • Melting Point: 180ºC
  • Flash Point: 636.3ºC

UNC-926

UNC-926 is a methyl-lysine (Kme) reader domain inhibitor; inhibits L3MBTL1 with an IC50 of 3.9 μM.

  • CAS Number: 1184136-10-4
  • MF: C16H21BrN2O
  • MW: 337.25500
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Topoisomerase II inhibitor 16

Topoisomerase II inhibitor 16 (compound CT3) is a selective, orally active, brain-penetrant and irreversible trypanosomal topoisomerase II inhibitor by stabilizing double-stranded DNA:enzyme cleavage complexes. Topoisomerase II inhibitor 16 has the potential for Chagas disease research[1].

  • CAS Number: 2403729-27-9
  • MF: C19H12F4N6O
  • MW: 416.33
  • Catalog: Topoisomerase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Acifluorfen

Acifluorfen, a protoporphyrinogen oxidase (PROTOX) inhibitor herbicide, promotes the accumulation of protoporphyrin IX (PPIX), and induces tumors in the rodent liver. Acifluorfen causes strong photooxidative destruction of pigments and lipids in sensitive plant species[1][2].

  • CAS Number: 50594-66-6
  • MF: C14H7ClF3NO5
  • MW: 361.657
  • Catalog: Others
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 422.4±45.0 °C at 760 mmHg
  • Melting Point: 161ºC
  • Flash Point: 209.2±28.7 °C

Cefamandole nafate

Cefamandole nafate is a second-generation broad-spectrum cephalosporin antibiotic.

  • CAS Number: 42540-40-9
  • MF: C19H17N6NaO6S2
  • MW: 512.495
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 190-193ºC
  • Flash Point: N/A

Rivoglitazone

Rivoglitazone is a thiazolidinedione-derivative PPARγ agonist for the treatment of type 2 diabetes mellitus.

  • CAS Number: 185428-18-6
  • MF: C20H19N3O4S
  • MW: 397.448
  • Catalog: PPAR
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 669.3±40.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 358.6±27.3 °C

19-Oxocinobufotalin

19-Oxocinobufotalin is capable of suppressing EMT (Epithelial-mesenchymal transition) and weakening the migratory and invasive potential of PC3 cells[1].

  • CAS Number: 24512-60-5
  • MF: C26H32O8
  • MW: 472.52700
  • Catalog: Cancer
  • Density: 1.40±0.1 g/cm3(Predicted)
  • Boiling Point: 662.8±55.0 °C(Predicted)
  • Melting Point: N/A
  • Flash Point: N/A

Afasevikumab

Afasevikumab (RG 7624; RO 5553110; NI-1401) is a fully human monoclonal IgG1κ antibody neutralizing both IL-17A and IL-17F. Afasevikumab has anti-inflammatory activities[1].

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

Amino-PEG24-alcohol

Amino-PEG24-alcohol is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 2226726-55-0
  • MF: C48H99NO24
  • MW: 1074.29
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BDY FL-X,SE

BODIPY FL-X,SE is a fluorescent green dye for the labeling of amine, shows a high fluorescence quantum yield and is relatively insensitive to pH change. BODIPY FL-X,SE can be used as an alternative for FAM, Cy2 or FITC. λabs: 504 nm; λem:510 nm[1].

  • CAS Number: 217190-09-5
  • MF: C24H29BF2N4O5
  • MW: 502.31900
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Polyketide synthase 13-IN-1

Polyketide synthase 13-IN-1 (compound 32) is a polyketide synthase 13 inhibitor[1].

  • CAS Number: 2345638-96-0
  • MF: C21H19NO4
  • MW: 349.38
  • Catalog: Infection
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Obeticholic acid

INT-747 is a potent and selective farnesoid X receptor (FXR) agonist with an EC50 of 99 nM.

  • CAS Number: 459789-99-2
  • MF: C26H44O4
  • MW: 420.625
  • Catalog: FXR
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 562.9±25.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 308.3±19.7 °C

Cisatracurium Besylate

Cisatracurium Besylate is a nondepolarizing neuromuscular blocking agent, antagonizing the action of acetylcholine by inhibiting neuromuscular transmission.Target: AChR alpha-2Cisatracurium is a neuromuscular-blocking drug or skeletal muscle relaxant in the category of non-depolarizing neuromuscular-blocking drugs, used adjunctively in anesthesia to facilitate endotracheal intubation and to provide skeletal muscle relaxation during surgery or mechanical ventilation. It is a bisbenzyltetrahydroisoquinolinium agent with an intermediate duration of action. Cisatracurium is one of the ten isomers of the parent molecule, atracurium. Moreover, cisatracurium represents approximately 15% of the atracurium mixture [1, 2].

  • CAS Number: 96946-42-8
  • MF: C65H82N2O18S2
  • MW: 1243.479
  • Catalog: Autophagy
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 90-93ºC
  • Flash Point: N/A

(rac)-Antineoplaston A10

(rac)-Antineoplaston A10 is the racemate of Antineoplaston A10. Antineoplaston A10 is a Ras inhibitor potentially for the treatment of glioma, lymphoma, astrocytoma and breast cancer[1].

  • CAS Number: 77658-84-5
  • MF: C13H14N2O3
  • MW: 246.26
  • Catalog: Cancer
  • Density: 1.27 g/cm3
  • Boiling Point: 571.2ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: N/A

PMEDAP

PMEDAP is a potent inhibitor of human immunodeficiency virus (HIV) replication. PMEDAP has anti-murine cytomegalovirus (MCMV) activity. PMEDAP is a very potent inhibitor of Moloney murine sarcoma virus (MSV)-induced tumor formation and associated mortality[1][2].

  • CAS Number: 113852-41-8
  • MF: C8H13N6O4P
  • MW: 288.20
  • Catalog: CMV
  • Density: 2.03g/cm3
  • Boiling Point: 748.7ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 406.6ºC

1-[[2'-(2,5-Dihydro-5-oxo-1,2,4-oxadiazol-3-yl)[1,1'-biphenyl]-4-yl]methyl]-2-ethoxy-1H-benzimidazole-7-carboxylic acid methyl ester

Azilsartan methyl ester, a derivative of Azilsartan (HY-14914), is an angiotensin II receptor antagonist that plays an important role in hypertension[1].

  • CAS Number: 147403-52-9
  • MF: C26H22N4O5
  • MW: 470.477
  • Catalog: Angiotensin Receptor
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 652.0±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 348.1±34.3 °C

H-D-Leu-Gly-OH

H-D-Leu-Gly-OH is a Glycine (HY-Y0966) derivative[1].

  • CAS Number: 997-05-7
  • MF: C8H16N2O3
  • MW: 188.22400
  • Catalog: Others
  • Density: 1.136g/cm3
  • Boiling Point: 410.4ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 202ºC