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

chloroacetyl-dl-valine

N-Chloroacetyl-DL-valine is a valine derivative[1].

  • CAS Number: 4090-17-9
  • MF: C7H12ClNO3
  • MW: 193.62800
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: 130ºC
  • Flash Point: N/A

Batefenterol

Batefenterol (GSK961081;TD-5959) is a novel muscarinic receptor antagonist and β2-adrenoceptor agonist; displays high affinity for hM2, hM3 muscarinic and hβ2-adrenoceptor with Ki values of 1.4, 1.3 and 3.7 nM, respectively.

  • CAS Number: 743461-65-6
  • MF: C40H42ClN5O7
  • MW: 740.244
  • Catalog: Adrenergic Receptor
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 948.3±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 527.3±34.3 °C

L-Theanine

L-Theanine (L-Glutamic Acid γ-ethyl amide)is a non-protein amino acid contained in green tea leaves, which blocks the binding of L-glutamic acid to glutamate receptors in the brain, and with neuroprotective and anti-oxidative activities. L-Theanine causes anti-stress effects via the inhibition of cortical neuron excitation by oral intake[1][2][3].

  • CAS Number: 3081-61-6
  • MF: C7H14N2O3
  • MW: 174.198
  • Catalog: Neurological Disease
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 430.2±40.0 °C at 760 mmHg
  • Melting Point: 207°C
  • Flash Point: 214.0±27.3 °C

Bella Fluor 594 Phalloidin

Bella Fluor 594 Phalloidin is a photostable red-fluorescent probe with a high affinity for F-actin (Excitation/Emission=581/609 nm). Bella Fluor 594 Phalloidin can be used in cytoskeletal protein imaging[1][2].

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

(2H14)-1,1':3',1''-Terphenyl

1,1':3',1''-Terphenyl-d14 is the deuterium labeled 1,1':3',1''-Terphenyl[1].

  • CAS Number: 17714-84-0
  • MF: C18D14
  • MW: 244.390
  • Catalog: Others
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 365.0±0.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 175.7±13.7 °C

Oxybutynin chloride

Oxybutynin is an anticholinergic medication used to relieve urinary and bladder difficulties.Target: mAChROxybutynin is an anticholinergic medication used to relieve urinary and bladder difficulties, including frequent urination and inability to control urination (urge incontinence), by decreasing muscle spasms of the bladder. Oxybutynin competitively antagonizes the M1, M2, and M3 subtypes of the muscarinic acetylcholine receptor. It also has direct spasmolytic effects on bladder smooth muscle as a calcium antagonist and local anesthetic, but at concentrations far above those used clinically. Oxybutynin is available orally in generic formulation or as the brand-names Ditropan, Lyrinel XL, or Ditrospam, as a transdermal patch under the brand name Oxytrol, and as a topical gel under the brand name Gelnique. Oxybutynin is also a possible treatment of hyperhidrosis (hyper-active sweating) [1-3].

  • CAS Number: 1508-65-2
  • MF: C22H32ClNO3
  • MW: 393.947
  • Catalog: mAChR
  • Density: N/A
  • Boiling Point: 494.4ºC at 760 mmHg
  • Melting Point: 126-128ºC
  • Flash Point: N/A

Metabutoxycaine

Metabutoxycaine is a local anesthetic[1].

  • CAS Number: 3624-87-1
  • MF: C17H28N2O3
  • MW: 308.41600
  • Catalog: Others
  • Density: 1.052g/cm3
  • Boiling Point: 442.7ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 221.6ºC

Tributyl phosphate-D27

Tributyl phosphate-d27 is the deuterium labeled Tributyl phosphate[1].

  • CAS Number: 61196-26-7
  • MF: C12H18D9O4P
  • MW: 275.37000
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MMG 11

MMG-11 is a potent and selective human TLR2 antagonist. MMG-11 inhibits both TLR2/1 and TLR2/6 signaling with an IC50 of 1.7 µM for Pam3CSK4-induced hTLR2/1 and 5.7 µM for Pam2CSK4-induced hTLR2/6 responses[1].

  • CAS Number: 313254-94-3
  • MF: C15H14O7
  • MW: 306.27
  • Catalog: Toll-like Receptor (TLR)
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

XEN907

XEN907 is a novel spirooxindole NaV1.7 blocker, inhibits hNaV1.7 with IC50 of 3 nM.IC50 value: 3 nMTarget: NaV1.7in vitro: XEN907 shows a further 10-fold increase in potency, represents a promising structure for further optimization efforts. XEN907 shows no significant activity at 10 μM against a broad panel of 63 receptors and transporters. Determination of the ADME properties of XEN907 reveals that XEN907 is not cytotoxic and has favourable hepatocyte metabolic stability for both human and dog, although inhibition of CYP3A4 is observed in a recombinant human enzyme assay.[1]in vivo: Pharmacokinetic analysis in rats of XEN907 demonstrates that, consistent with the compound's ADME parameters, the compound is modestly bioavailable. Following an initial rapid absorption phase (oral Tmax = 20 min), XEN907 is extensively distributed (Vss 600-fold higher than the plasma volume in rats) and rapidly cleared. [1]

  • CAS Number: 912656-34-9
  • MF: C21H21NO4
  • MW: 351.396
  • Catalog: Sodium Channel
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 566.9±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 296.6±30.1 °C

5-FAM-Amyloid β-Protein (1-42) trifluoroacetate salt

β-Amyloid (1-42), human, FAM-labeled is a biological active peptide. (FAM labled HY-P1363)

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

Pilocarpine

Pilocarpine is a selective M3-type muscarinic acetylcholine receptor (M3 muscarinic receptor) agonist.

  • CAS Number: 92-13-7
  • MF: C11H16N2O2
  • MW: 208.257
  • Catalog: AMPK
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 431.8±18.0 °C at 760 mmHg
  • Melting Point: 34℃
  • Flash Point: 215.0±21.2 °C

H-Arg-Ile-OH

Arginylisoleucine is a biologically active peptide.

  • CAS Number: 62632-70-6
  • MF: C14H29N5O5
  • MW: 347.41100
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

D-Tyrosine-d2

D-Tyrosine-d2 is the deuterium labeled D-Tyrosine. D-Tyrosine is the D-isomer of tyrosine. D-Tyrosine negatively regulates melanin synthesis by inhibiting tyrosinase activity. D-Tyrosine inhibits biofilm formation and trigger the self-dispersal of biofilms without suppressing bacterial growth[1][2].

  • CAS Number: 1202064-22-9
  • MF: C9H9D2NO3
  • MW: 183.20
  • Catalog: Tyrosinase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Evolitrine

Evolitrine (7-Methoxydictamnine; Evolitrin) is isolated from Acronychia pedunculata and show anti-inflammatory and antifeedant activities[1].

  • CAS Number: 523-66-0
  • MF: C13H11NO3
  • MW: 229.23100
  • Catalog: Inflammation/Immunology
  • Density: 1.261g/cm3
  • Boiling Point: 381ºC at 760mmHg
  • Melting Point: 115℃
  • Flash Point: 184.2ºC

CCK (26-31) (non-sulfated)

CCK (26-31) (non-sulfated) is the N-terminal fragment of CCK, a peptide hormone found in the gut and brain that stimulates digestion, regulates satiety, and is associated with anxiety. CCK (26-31) is also less active in non-sulfated than in sulfated form[1].

  • CAS Number: 89911-64-8
  • MF: C38H50N8O10S2
  • MW: 842.981
  • Catalog: Metabolic Disease
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 1110.0±75.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 625.1±37.1 °C

beta-zearalenol

β-Zearalenol is a non-steroidal estrogenic mycotoxin synthesized by Fusarium species. β-Zearalenol potentially influences transcription and effects gene expression on translational level[1].

  • CAS Number: 71030-11-0
  • MF: C18H24O5
  • MW: 320.38000
  • Catalog: Others
  • Density: 1.174g/cm3
  • Boiling Point: 599ºC at 760 mmHg
  • Melting Point: 137-139ºC
  • Flash Point: 217.9ºC

6-Hydroxybenzbromarone

6-Hydroxybenzbromarone is the major metabolite of Benzbromarone with a longer half-life and greater pharmacological potency than the parent compound. 6-Hydroxybenzbromarone is a protein Eyes Absent 3 (EYA3) inhibitor with an IC50 value of 21.5 μM. 6-Hydroxybenzbromarone is an angiogenic agent, has strong inhibitory effects on cell migration, tubulogenesis, and angiogenic sprouting[1].

  • CAS Number: 152831-00-0
  • MF: C17H12Br2O4
  • MW: 440.08300
  • Catalog: Phosphatase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

RPH-2823

RPH-2823 is a basic triamterene derivative, with diuretic activity.

  • CAS Number: 96558-24-6
  • MF: C17H22N8O2
  • MW: 370.409
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 690.8±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 371.6±34.3 °C

Brasofensine sulfate

Brasofensine (BMS-204756) sulfate is a dopamine transporter antagonist and can be used for parkinson’s disease research[1].

  • CAS Number: 171655-92-8
  • MF: C16H22Cl2N2O5S
  • MW: 425.32700
  • Catalog: Monoamine Oxidase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Gymnoside III

Gymnoside III is a glucosyloxybenzyl 2-isobutylmalate isolated from the tubers of Gymnadenia conopsea.

  • CAS Number: 899430-03-6
  • MF: C42H58O23
  • MW: 930.9
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

PEG20-Tos

PEG20-Tos is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 2179113-08-5
  • MF: C47H88O23S
  • MW: 1053.25
  • Catalog: PROTAC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Harzianic acid

Harzianic acid, a tetramic acid derivative, with activity of antimicrobial, antibiofilm formation and biofilm disaggregation. Harzianic acid interferes with biofilm formation by limiting bacterial iron availability. Harzianic acid is also a selective inhibitor of Acetohydroxyacid synthase (AHAS), the first enzyme in the branched-chain amino acid biosynthetic pathway. Harzianic acid can used for herbicide and fungicide[1][2].

  • CAS Number: 157148-06-6
  • MF: C19H27NO6
  • MW: 365.42100
  • Catalog: Fungal
  • Density: 1.233g/cm3
  • Boiling Point: 539.8ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 280.3ºC

Maraniol

7-Ethoxy-4-methylcoumarin is a coumarin derivative and can be used as a substrate probe of mammalian cytochromes P450 1A1, 2B4 and 2B6[1][2].

  • CAS Number: 87-05-8
  • MF: C12H12O3
  • MW: 204.222
  • Catalog: Cytochrome P450
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 351.4±37.0 °C at 760 mmHg
  • Melting Point: 114-116 °C(lit.)
  • Flash Point: 146.2±21.1 °C

H-D-Glu(Gly-OH)-OH

gamma-DGG is a competitive AMPA receptor blocker.

  • CAS Number: 6729-55-1
  • MF: C7H12N2O5
  • MW: 204.18100
  • Catalog: iGluR
  • Density: N/A
  • Boiling Point: 586.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 308.6ºC

Mdivi-1

Mdivi-1 is a selective dynamin-related protein 1 (Drp1) inhibitor.

  • CAS Number: 338967-87-6
  • MF: C15H10Cl2N2O2S
  • MW: 353.223
  • Catalog: Dynamin
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 522.5±60.0 °C at 760 mmHg
  • Melting Point: 289 °C
  • Flash Point: 269.8±32.9 °C

N-Nitrosodi-n-butylamine-d18

N-Nitrosodibutylamine-d18 is the deuterium labeled N-Nitrosodibutylamine[1]. N-Nitrosodibutylamine (N-Nitroso-di-n-butylamine) is a nitrosamine enriched in the drinking water[2].

  • CAS Number: 1219798-82-9
  • MF: C8D18N2O
  • MW: 176.352232004
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

UNII:ST90Q60YF3

3,5-Diiodo-D-tyrosine is a tyrosine derivative[1].

  • CAS Number: 16711-71-0
  • MF: C9H9I2NO3
  • MW: 432.982
  • Catalog: Others
  • Density: 2.4±0.1 g/cm3
  • Boiling Point: 410.5±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 202.1±28.7 °C

α-lytic endopeptidase

From the myxobacterium Lysobacter enzymogenes. In peptidase family S1 (trypsin family) Reaction: Preferential cleavage: Ala┼, Val┼ in bacterial cell walls, elastin and other proteins

  • CAS Number: 37288-76-9
  • MF:
  • MW:
  • Catalog: Ser/Thr Protease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BP-1-102

BP-1-102 is an orally available, small-molecule inhibitor of transcription factor Stat3, with an IC50 of 6.8 μM.

  • CAS Number: 1334493-07-0
  • MF: C29H27F5N2O6S
  • MW: 626.591
  • Catalog: STAT
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 749.2±70.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 406.9±35.7 °C