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

Lemalesomab

Lemalesomab (IMMU-MN3) is a mouse IgG1 Anti-NCA-90 monoclonal antibody and a Fab'fragment. Lemalesomab can be used for the research of inflammation, infectious lesions and infection imaging[1].

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

Pseudobufarenogin

Pseudobufarenogin is a natural compound extracted from toad species with unknown details.

  • CAS Number: 17008-69-4
  • MF: C24H32O6
  • MW: 416.507
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 635.8±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 218.7±25.0 °C

Bleximenib oxalate

Menin-MLL inhibitor 24 (compound A) oxalate is a menin-mixed-lineage leukemia 1 (menin-MLL) inhibitor, and can be used for the research of cancer[1].

  • CAS Number: 2866179-95-3
  • MF: C34H52FN7O7
  • MW: 689.82
  • Catalog: Epigenetic Reader Domain
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

NSC-60339

NSC-60339, an efflux pump inhibitor and a substrate of AcrAB-TolC, is a polybasic terephthalic acid derivative studied as a potential cancer chemotherapeutic agent[1][2].

  • CAS Number: 70-09-7
  • MF: C26H23ClN6O2
  • MW: 486.95300
  • Catalog: Bacterial
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-(3-Mercapto-2-methylpropanoyl)glycine-d5

N-(3-Mercapto-2-methylpropanoyl)glycine-d5 is the deuterium labeled N-(3-Mercapto-2-methylpropanoyl)glycine[1].

  • CAS Number: 1184993-97-2
  • MF: C6H6D5NO3S
  • MW: 182.25
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Vepsitamab

Vepsitamab (AMG 199) is an anti-MUC17/CD3 BiTE antibody that binds to CD3 on T cells and MUC17 expressed on tumor cells, mediates redirected tumor cell lysis, and induces T cell activation and proliferation[1].

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

Forodesine (hydrochloride)

Forodesine hydrochloride is a potent and oral purine nucleoside phosphorylase (PNP) inhibitor with IC50s ranging from 0.48 to 1.57 nM.

  • CAS Number: 284490-13-7
  • MF: C11H15ClN4O4
  • MW: 302.71400
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ZINC475239213

ZINC475239213 is an inhibitor of the SARS-CoV-2 Nsp14 N7-Methyltransferase (IC50: 20 μM)[1].

  • CAS Number: 2871002-89-8
  • MF: C21H15N5O2
  • MW: 369.38
  • Catalog: SARS-CoV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Isovalerylshikonin

Isovalerylshikonin (IVS) is a shikonin pigment is identified in the root epidermis of Echium italicum L[1].

  • CAS Number: 52387-14-1
  • MF: C21H24O6
  • MW: 372.41200
  • Catalog: Others
  • Density: 1.246g/cm3
  • Boiling Point: 570.1ºC at 760 mmHg
  • Melting Point: 107ºC
  • Flash Point: 198.6ºC

N-(4-cyanophenyl)-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

H1PVAT is a potent and selective inhibitor of poliovirus serotypes (PV-1, PV-2, PV-3), and inhibits early stage of the replication. H1PVAT interacts with viral capsid directly and protects PV against heat inactivation[1][2].

  • CAS Number: 351438-49-8
  • MF: C19H14F3N5OS
  • MW: 417.408
  • Catalog: Infection
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(R)-3-O-Methyldopa-d3 hydrochloride

(R)-3-O-Methyldopa-d3 hydrochloride is a deuterium labeled (R)-3-O-Methyldopa, and (R)-3-O-Methyldopa is an R-enantiomer of 3-O-Methyldopa. 3-O-Methyldopa is a metabolite of L-DOPA which is formed by catechol-O-methyltransferase (COMT). 3-O-Methyldopa competitively inhibits the pharmacodynamics of L-DOPA and dopamine[1][2].

  • CAS Number: 2714485-35-3
  • MF: C10H11D3ClNO4
  • MW: 250.69
  • Catalog: Dopamine Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Nitromifene

Nitromifene is an antagonist of estrogen receptor (ER).

  • CAS Number: 10448-84-7
  • MF: C27H28N2O4
  • MW: 444.52200
  • Catalog: Cancer
  • Density: 1.183g/cm3
  • Boiling Point: 576.7ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 302.6ºC

6,7,4'-Trihydroxyisoflavone

Desmethylglycitein (4',6,7-Trihydroxyisoflavone), a metabolite of daidzein, sourced from Glycine max with antioxidant, and anti-cancer activities.Desmethylglycitein binds directly to CDK1 and CDK2 in vivo, resulting in the suppresses CDK1 and CDK2 activity[1]. Desmethylglycitein is a direct inhibitor of protein kinase C (PKC)α, against solar UV (sUV)-induced matrix matrix metalloproteinase 1 (MMP1)[2]. Desmethylglycitein binds to PI3K in an ATP competitive manner in the cytosol, where it inhibits the activity of PI3K and downstream signaling cascades, leading to the suppression of adipogenesis in 3T3-L1 preadipocytes[3].

  • CAS Number: 17817-31-1
  • MF: C15H10O5
  • MW: 270.23700
  • Catalog: CDK
  • Density: 1.548g/cm3
  • Boiling Point: 587.1ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 229.7ºC

Fenchol

Fenchyl alcohol is a monoterpene alcohol in the essential oils isolated from Douglas fir needles, acts as a fragrance. Fenchyl alcohol strongly inhibits the rumen microbial activity of both sheep and deer[1][2].

  • CAS Number: 1632-73-1
  • MF: C10H18O
  • MW: 154.249
  • Catalog: Infection
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 202.9±8.0 °C at 760 mmHg
  • Melting Point: 35-40ºC
  • Flash Point: 73.9±0.0 °C

Acetylcimigenol 3-O-alpha-L-arabinopyranside

Acetylshengmanol Arabinoside is isolated from Cimicifugae rhizoma.

  • CAS Number: 402513-88-6
  • MF: C37H58O10
  • MW: 662.850
  • Catalog: Others
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 748.5±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 225.6±26.4 °C

cis-Jasmone

Cis-Jasmone is a plant-derived natural product. Cis-Jasmone is constitutively released by many flowers and sometimes by leaves as an attractant for pollinators or as a chemical cue for host location by insect flower herbivores. Cis-Jasmone treatment of crop plants not only induces direct defense against herbivores, but also induces indirect defense by releasing VOCs that attract natural enemies[1].

  • CAS Number: 488-10-8
  • MF: C11H16O
  • MW: 164.244
  • Catalog: Others
  • Density: 0.9±0.1 g/cm3
  • Boiling Point: 264.2±0.0 °C at 760 mmHg
  • Melting Point: 203 - 205ºC
  • Flash Point: 107.2±0.0 °C

MKC-1

MKC-1 (Ro-31-7453) is an orally active and potent cell cycle inhibitor with broad antitumor activity. MKC-1 inhibits the Akt/mTOR pathway. MKC-1 arrests cellular mitosis and induces cell apoptosis by binding to a number of different cellular proteins including tubulin and members of the importin β family[1][2][3].

  • CAS Number: 125313-92-0
  • MF: C22H16N4O4
  • MW: 400.38700
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

NEO2734

NEO2734 (EP31670) is an orally active dual p300/CBP and BET bromodomain selective inhibitor, with IC50 values of <30 nM for both p300/CBP and BET bromodomains[1]. NEO2734 is active in SPOP mutant and wild-type prostate cancer[2].

  • CAS Number: 2081072-29-7
  • MF: C22H24F3N3O3
  • MW: 435.44
  • Catalog: Epigenetic Reader Domain
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ACTINONIN

Actinonin ((-)-Actinonin) is a naturally occurring antibacterial agent produced by Actinomyces. Actinonin inhibits aminopeptidase M, aminopeptidase N and leucine aminopeptidase. Actinonin is a potent reversible peptide deformylase (PDF) inhibitor with a Ki of 0.28 nM. Actinonin also inhibits MMP-1, MMP-3, MMP-8, MMP-9, and hmeprin α with Ki values of 300 nM, 1,700 nM, 190 nM, 330 nM, and 20 nM, respectively. Actinonin is an apoptosis inducer. Actinonin has antiproliferative and antitumor activities[1][2][3][4][5].

  • CAS Number: 13434-13-4
  • MF: C19H35N3O5
  • MW: 385.498
  • Catalog: Bacterial
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: 137-139ºC
  • Flash Point: N/A

APX001

APX001 (APX 001A;E1210) is a novel broad-spectrum antifungal agent that inhibits the fungal protein Gwt1, demonstrates significantly acitive MIC50 and MIC90 values of 0.004 and 0.031 ug/ml (16 strains of C. auris); inhibits the inositol acylation activity of C. albicans Gwt1p and A. fumigatus Gwt1p with IC50 of 0.3 to 0.6 uM but has no inhibitory activity against human Pig-Wp; shows significant efficacy in murine model of disseminated C. auris infection, and log reduction in CFU counts in kidney, lung, and brain tissue. Fungal Infection Phase 1 Clinical

  • CAS Number: 936339-60-5
  • MF: C21H18N4O2
  • MW: 358.393
  • Catalog: Fungal
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 569.4±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 298.1±28.7 °C

6-O-Syringoylajugol

6-O-Syringoylajugol (compound 65) is a natural product that can be found in Verbacum spp[1].

  • CAS Number: 144049-72-9
  • MF: C24H32O13
  • MW: 528.50
  • Catalog: Others
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 762.5±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 256.4±26.4 °C

Pendimethalin

Pendimethalin is an herbicide that controls annual grasses and certain broadleaf weeds. Pendimethalin inhibits cell division and cell elongation[1].

  • CAS Number: 40487-42-1
  • MF: C13H19N3O4
  • MW: 281.308
  • Catalog: Others
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 421.0±45.0 °C at 760 mmHg
  • Melting Point: 56-57°C
  • Flash Point: 208.4±28.7 °C

Ftase inhibitor III

Ftase inhibitor III is an anion-dependent Farnesyltransferase inhibitor from a phenotypic screen.

  • CAS Number: 2710375-18-9
  • MF: C24H34N6O
  • MW: 422.57
  • Catalog: Farnesyl Transferase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

m-PEG7-Tos

m-PEG7-Tos is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 79622-11-0
  • MF: C22H38O10S
  • MW: 494.59600
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

3'-FLUORO-3'-DEOXYCYTIDINE

3′-Deoxy-3′-fluorocytidine is a purine nucleoside analogue. Purine nucleoside analogs have broad antitumor activity targeting indolent lymphoid malignancies. Anticancer mechanisms in this process rely on inhibition of DNA synthesis, induction of apoptosis, etc[1].

  • CAS Number: 123402-20-0
  • MF: C9H12FN3O4
  • MW: 245.21
  • Catalog: Nucleoside Antimetabolite/Analog
  • Density: 1.82g/cm3
  • Boiling Point: 500.1ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 256.2ºC

4'-Methoxypuerarin

4'-Methoxypuerarin (4'-O-Methylpuerarin), an isoflavone diglycoside, is isolated from Pueraria lobata[1].

  • CAS Number: 92117-94-7
  • MF: C22H22O9
  • MW: 430.405
  • Catalog: Others
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 661.7±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 232.2±25.0 °C

NIK SMI1

NIK SMI1 is a potent, selective NF-κB inducing kinase (NIK) inhibitor, which inhibits NIK-catalyzed hydrolysis of ATP to ADP with IC50 of 0.23±0.17 nM.

  • CAS Number: 1660114-31-7
  • MF: C20H19N3O4
  • MW: 365.38
  • Catalog: NF-κB
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Dodecyl glycinate

Dodecyl glycinate is a Glycine (HY-Y0966) derivative[1].

  • CAS Number: 13827-65-1
  • MF: C14H29NO2
  • MW: 243.38600
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Gibberellin A1

Gibberellin A1 is a kind of plant hormones. Gibberellin A1 is a growth-promoting acids isolated from immature seed of Phaseolus multiflorus[1].

  • CAS Number: 545-97-1
  • MF: C19H24O6
  • MW: 348.390
  • Catalog: Others
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 619.7±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 227.0±25.0 °C

NK3R-IN-1

NK3R-IN-1 (compound 16x), a imidazolepiperazine derivative, is an orally active Neurokinin Receptor NK3R inhibitor. NK3R-IN-1 decreases blood luteinizing hormone levels in ovariectomy (OVX) model[1].

  • CAS Number: 2854331-14-7
  • MF: C17H16FN5OS
  • MW: 357.41
  • Catalog: Neurokinin Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A