Chemsrc provides Research Areas's classification. They are divided into Others, Cancer, Cardiovascular Disease, Endocrinology, Infection, Inflammation/Immunology, Metabolic Disease, Neurological Disease 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

(R)-3-Hydroxybutanoic acid-13c sodium

(R)-3-Hydroxybutanoic acid-13C (sodium) is the 13C labeled (R)-3-Hydroxybutanoic acid sodium[1]. (R)-3-Hydroxybutanoic acid sodium ((R)-3-Hydroxybutyric acid) is a metabolite converted from acetoacetic acid catalyzed by 3-hydroxybutyrate dehydrogenase. (R)-3-Hydroxybutanoic acid sodium can function as a nutrition source, and as a precursor for vitamins, antibiotics and pheromones[2][3].

  • CAS Number: 13291-89-9
  • MF: C2H3NaO2
  • MW: 83.02640
  • Catalog: Metabolic Disease
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: >300ºC (dec.)(lit.)
  • Flash Point: N/A

VH 032-linker 6

VH032-PEG3-acetylene is a synthesized E3 ligase ligand-linker conjugate that incorporates the VH032 based VHL ligand and a linker used in PROTAC technology[1].

  • CAS Number: 2098799-80-3
  • MF: C31H42N4O7S
  • MW: 614.75
  • Catalog: Cancer
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MAO-B-IN-16

MAO-B-IN-16 is a selective monoamine oxidase B (MAO-B) inhibitor, with an IC50 of 1.55 µM. MAO-B-IN-16 can be used in the study of central nervous disorders, such as parkinson's disease[1].

  • CAS Number: 1021238-13-0
  • MF: C18H19NO3
  • MW: 297.35
  • Catalog: Monoamine Oxidase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ald-Ph-amido-PEG2-C2-Boc

Ald-Ph-amido-PEG2-C2-Boc is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

  • CAS Number: 1807521-09-0
  • MF: C19H27NO6
  • MW: 365.421
  • Catalog: PROTAC Linker
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 547.6±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 285.0±28.7 °C

JAK1/TYK2-IN-1

JAK1/TYK2-IN-1 is a dual inhibitor of TYK2 and JAK1 (IC50 = 29 and 41 nM respectively).

  • CAS Number: 1883300-48-8
  • MF: C18H20F3N7O
  • MW: 407.39
  • Catalog: JAK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Sominone

Sominone is a withanolide. Sominone can be isolated from the herbs of Withania somnifera[1].

  • CAS Number: 98569-64-3
  • MF: C28H42O5
  • MW: 458.63000
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

L-765,314

L-765314 is a potent and selective α1b adrenergic receptor antagonist with Kis of 5.4 nM and 2.0 nM for rat and human α1b adrenergic receptor, respectively.

  • CAS Number: 189349-50-6
  • MF: C27H34N6O5
  • MW: 522.59600
  • Catalog: Adrenergic Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SR 3029

SR-3029 is a potent and ATP competitive CK1δ and CK1ε inhibitor, with IC50s of 44 nM and 260 nM, respectively, and Kis of 97 nM for both kinases.

  • CAS Number: 1454585-06-8
  • MF: C23H19F3N8O
  • MW: 480.445
  • Catalog: Casein Kinase
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 818.7±75.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 448.9±37.1 °C

Dextrothyroxine

D-Thyroxine (D-T4) is a thyroid hormone that can inhibit TSH secretion. D-Thyroxine can be used for the research of hypercholesterolemia[1][2].

  • CAS Number: 51-49-0
  • MF: C15H11I4NO4
  • MW: 776.870
  • Catalog: Metabolic Disease
  • Density: 2.6±0.1 g/cm3
  • Boiling Point: 576.3±50.0 °C at 760 mmHg
  • Melting Point: 225ºC
  • Flash Point: 302.3±30.1 °C

Heliotropic acid

Piperonylic acid is a natural molecule bearing a methylenedioxy function that closely mimics the structure of trans-cinnamic acid. Piperonylic Acid is a selective, mechanism-based inactivator of the trans-cinnamate 4-Hydroxylase[1].

  • CAS Number: 94-53-1
  • MF: C8H6O4
  • MW: 166.131
  • Catalog: Cytochrome P450
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 324.6±31.0 °C at 760 mmHg
  • Melting Point: 229-231 °C(lit.)
  • Flash Point: 139.6±18.3 °C

Doxorubicin Hydrochloride

Doxorubicin hydrochloride is a cytotoxic anthracycline antibiotic for the treatment of multiple cancers. The possible mechanisms by which doxorubicin acts in the cancer cell are intercalation into DNA and disruption of topoisomerase-II-mediated DNA repair.

  • CAS Number: 25316-40-9
  • MF: C27H30ClNO11
  • MW: 579.980
  • Catalog: ADC Cytotoxin
  • Density: N/A
  • Boiling Point: 810.3ºC at 760 mmHg
  • Melting Point: 216ºC
  • Flash Point: 443.8ºC

11beta,17alpha-dihydroxy-4-pregnene-3,20-dione

21-Deoxycortisol is an endogenous metabolite. 21-Deoxycortisol is a sign of congenital adrenal hyperplasia[1].

  • CAS Number: 641-77-0
  • MF: C21H30O4
  • MW: 346.46100
  • Catalog: Endocrinology
  • Density: 1.21g/cm3
  • Boiling Point: 523.9ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 284.7ºC

(Rac)-cis-3-hydroxy glyburide-13C,d3

(Rac)-cis-3-hydroxy glyburide-13C,d3 is a 13C-labeled and deuterium labeled (Rac)-cis-3-hydroxy glyburide[1].

  • CAS Number: 1217848-91-3
  • MF: C2213CH25D3ClN3O6S
  • MW: 514.01
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

(E)-2-HEXENOL

(E)-Hex-2-en-1-ol is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

  • CAS Number: 928-95-0
  • MF: C6H12O
  • MW: 100.159
  • Catalog: Others
  • Density: 0.8±0.1 g/cm3
  • Boiling Point: 159.6±8.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 61.7±0.0 °C

Atilmotin

OHM 11638 (Atilmotin), an analogue of the (1-14) fragment of porcine motilin, is a motilin receptor agonist with a pKd of 8.94 for the motilin receptor. OHM 11638 affects esophageal, lower esophageal sphincter (LES), and gastric motility. OHM 11638 increases LES and gastric pressures, OHM 11638 can be used as prokinetic agents[1][2].

  • CAS Number: 533927-56-9
  • MF: C86H135N20O19+
  • MW: 1753.11
  • Catalog: Motilin Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

5-Methoxy-2-benzimidazolethiol

5-Methoxy-2-benzimidazolethiol is a benzimidazole. The iodimetric determination of 5-Methoxy-2-benzimidazolethiol in alkaline media is studied[1].

  • CAS Number: 37052-78-1
  • MF: C8H8N2OS
  • MW: 180.227
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 309.4±44.0 °C at 760 mmHg
  • Melting Point: 261-263 °C(lit.)
  • Flash Point: 140.9±28.4 °C

Dasabuvir sodium

Dasabuvir (ABT-333) sodium is a nonnucleoside hepatitis C virus (HCV) polymerase inhibitor. Dasabuvir sodium inhibits RNA-dependent RNA polymerase encoded by the HCV NS5B gene. Dasabuvir sodium inhibits genotype 1a (strain H77) and 1b (strain Con1) replicons, with EC50 values of 7.7 and 1.8 nM, respectively[1].

  • CAS Number: 1132940-11-4
  • MF: C26H26N3NaO5S
  • MW: 515.55700
  • Catalog: HCV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Tup hydrochloride

Tup hydrochloride is a cleavable ADC linker.

  • CAS Number: 1200041-11-7
  • MF: C12H18ClNO3
  • MW: 259.73
  • Catalog: ADC Linker
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Cas9-IN-3

Cas9-IN-3 is a potent Cas9 inhibitor (IC50=28 μM). CRISPR/Cas systems have revolutionized gene editing in various species[1].

  • CAS Number: 2322051-02-3
  • MF: C19H21NO
  • MW: 279.38
  • Catalog: CRISPR/Cas9
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

chlorcyclizine hydrochloride

Chlorcyclizine hydrochloride is a histamine H1 antagonist.

  • CAS Number: 14362-31-3
  • MF: C18H22Cl2N2
  • MW: 337.287
  • Catalog: Histamine Receptor
  • Density: 1.145g/cm3
  • Boiling Point: 393.6ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 191.9ºC

BMS-935177

BMS-935177 is a potent and selective reversible inhibitor of Bruton’s tyrosine kinase (Btk) with an IC50 of 3 nM.

  • CAS Number: 1231889-53-4
  • MF: C31H26N4O3
  • MW: 502.563
  • Catalog: Btk
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 805.4±75.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 440.9±37.1 °C

Siraitic acid B

Siraitic Acid B is a cucurbitane triterpenoid isolated from the root of S. grosvenori [1].

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

N-(3-hydroxyphenyl)-Arachidonoyl amide

N-(3-Hydroxyphenyl)-arachidonoyl amide (Compound 23) is an anandamide transport inhibitor with an IC50 of 21.3 μM[1].

  • CAS Number: 183718-75-4
  • MF: C26H37NO2
  • MW: 395.58
  • Catalog: Neurological Disease
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 579.4±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 304.2±30.1 °C

Bictegravir Sodium

Bictegravir sodium is a potent inhibitor of HIV-1 integrase, with an IC50 of 7.5 nM. Bictegravir sodium exhibits potent and selective anti-HIV activity and low cytotoxicity[1].

  • CAS Number: 1807988-02-8
  • MF: C21H17F3N3NaO5
  • MW: 471.362
  • Catalog: HIV
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Nebicapone

Nebicapone (BIA 3-202), a reversible catechol-O-methyltransferase (COMT) inhibitor, is mainly metabolized by glucuronidation. Nebicapone is mainly peripherally acting inhibitor that decreases the biotransformation of L-DOPA to 3-O-methyl-DOPA by inhibition of COMT, and it is potential for the treatment of Parkinson's disease.[1].

  • CAS Number: 274925-86-9
  • MF: C14H11NO5
  • MW: 273.24100
  • Catalog: COMT
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

4,4'-Sulfonyldiphenol-d8

4,4'-Sulfonyldiphenol-d8 is the deuterium labeled 4,4'-Sulfonyldiphenol[1].

  • CAS Number: 2483831-28-1
  • MF: C12H2D8O4S
  • MW: 258.32
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MTX115325

MTX115325 (Example 1) is an orally active, brain-penetrating USP30 inhibitor (IC50=12 nM) with neuroprotective activity. MTX115325 increases ubiquitination (EC50=32 nM) of the mitochondrial outer membrane protein TOM20 (a USP30 substrate), increasing mitophagy. MTX115325 prevents dopaminergic neuron loss and preserves striatal dopamine[1].

  • CAS Number: 2750895-97-5
  • MF: C18H16N6O2
  • MW: 348.36
  • Catalog: Deubiquitinase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

6-Acetonyldihydrosanguinarine

6-Acetonyldihydrosanguinarine is a compound isolated from the aerial parts of Chelidonium majus L..[1]

  • CAS Number: 37687-34-6
  • MF: C23H19NO5
  • MW: 389.401
  • Catalog: Others
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 597.3±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 315.0±30.1 °C

AZ506

AZ506 is a potent SMYD2 inhibitor with an IC50 of 17 nM. AZ506 inhibits SMYD2 methyltransferase activity in cells, leading to a decrease in the SMYD2-mediated methylation signal.

  • CAS Number: 2043321-54-4
  • MF: C33H40N6O
  • MW: 536.71
  • Catalog: Histone Methyltransferase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Obtusifolin

Obtusifolin, isolated from the seeds of Cassia obtusifolia, regulates the gene expression and production of MUC5AC mucin in airway epithelial cells via inhibiting NF-kB pathway[1]. Obtusifolin suppresses phthalate esters-induced breast cancer bone metastasis by targeting parathyroid hormone-related protein[2].

  • CAS Number: 477-85-0
  • MF: C16H12O5
  • MW: 284.263
  • Catalog: Cancer
  • Density: 1.448±0.06 g/cm3
  • Boiling Point: 528.0±50.0 °C at 760 mmHg
  • Melting Point: 242-243ºC
  • Flash Point: 202.2±23.6 °C