Elimusertib hydrochloride
Based on 17 publication(s) in Google Scholar
Elimusertib (BAY 1895344) hydrochloride is a potent, orally active and selective ATR inhibitor with an IC50 of 7 nM. Elimusertib hydrochloride has anti-tumor activity. Elimusertib hydrochloride can be used for the research of solid tumors and lymphomas.
For research use only. We do not sell to patients.
- Purity: 99.85%
- Formula: C20H22ClN7O
- Molecular Weight:411.89
-
Storage:
4°C, sealed storage, away from moisture
* In solvent : -80°C, 2 years; -20°C, 1 year (sealed storage, away from moisture)
Publications Citing Use of MedChemExpress (MCE) Elimusertib hydrochloride
More- Cancer Res. 2022 Mar 15;82(6):1013-1024. [Abstract]
- Nat Commun. 2026 Mar 21. [Abstract]
- Nat Commun. 2024 Oct 24;15(1):9195. [Abstract]
- Exp Mol Med. 2025 Feb;57(1):167-183. [Abstract]
- Cell Rep Med. 2025 May 6:102129. [Abstract]
- Sci Adv. 2026 May;12(18):eadz9284. [Abstract]
- Cancer Lett. 2026 Feb 4;642:218300.
- Cancer Lett. 2026 Apr 1:642:218300. [Abstract]
- J Med Chem. 2024 Feb 22;67(4):2349-2368. [Abstract]
- Biochem Pharmacol. 2023 May:211:115494. [Abstract]
- RSC Adv. 2025 Jun 16;15(26):20385-20396. [Abstract]
- EMBO Rep. 2024 Mar;25(3):1469-1489. [Abstract]
- Mol Cell Biol. 2025;45(3):99-115. [Abstract]
- bioRxiv. 2025 Sep 29:2025.09.28.674326. [Abstract]
- Research Square Preprint. 2023 Nov 20.
- Research Square Preprint. 2023 Jun 9.
- Research Square Preprint. 2023 May 17.
-
WB
-
Bio/Physico-chemical Assay
-
Cell Proliferation/Viability Assay
-
WB
-
WB
Biological Activity
|
ATR 7 nM (IC50) |
Elimusertib hydrochloride potently inhibits the proliferation of a broad spectrum of human tumor cell lines with a median IC50 of 78 nM[1].
Elimusertib hydrochloride potently suppresses hydroxyurea-induced H2AX phosphorylation (IC50: 36 nM)[1].
Elimusertib hydrochloride shows good selectivity against mTOR (ratio of IC50 values: mTOR/ATR 61)[3].
Elimusertib hydrochloride reveals high selectivity against other related kinases, such as DNA-PK (IC50: 332 nM), ATM (IC50: 1420 nM), and PI3K (IC50: 3270 nM)[3].
Elimusertib hydrochloride has potent antiproliferative activity against various cancer cell lines in vitro, 25 for example in the CRC cell lines HT-29 (IC50: 160 nM) and LoVo (IC50: 71 nM), and in the B-cell lymphoma cell line SU-DHL-8 (IC50: 9 nM)[3].
MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.
Elimusertib hydrochloride (50 mg/kg; p.o.; b.i.d.; 3 days on/4 days off; for 11 days) exhibits strong antitumor efficacy in the ATM-mutated SU-DHL-8 (ATM K1964E) human GCB-DLBCL cell line derived xenograft model in mice[3].
Elimusertib hydrochloride (20 mg/kg, and 10 mg/kg from day 14; p.o.; daily; 2 days on/5 days off; for 42 days) in combination with Carboplatin (40 mg/kg; i.p.; daily; 1 day on/6 days off) results in synergistic antitumor activity in the platinum-resistant ATM protein low expressing CR5038 human CRC PDX model in NOD/SCID mice[3].
Elimusertib hydrochloride exhibits moderate oral bioavailability (rat 87%, dog 51%) following oral administration (rat and dog 0.6-1 mg/kg)[3].
Elimusertib hydrochloride exhibits terminal elimination half-lives (mouse 0.17 h, rat 1.3 and, dog 1.0 h) due to plasma clearance (3.5, 1.2, and 0.79 L/h/kg respectively) following intravenous administration (mouse, rat and dog 0.3-0.5 mg/kg)[3].
MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.
-
Animal Model:Female C.B-17 SCID mice, SU-DHL-8 GCB-DLBCL xenograft model[3]
-
Dosage:50 mg/kg
-
Administration:Oral administration, b.i.d., 3 days on/4 days off, for 11 days
-
Result:Inhibited tumor area.
-
Animal Model:Male Wistar rats[3]
-
Dosage:0.3-0.5 mg/kg for i.v.; 0.6-1 mg/kg for oral (Pharmacokinetic Analysis)
-
Administration:Intravenous injection and oral administration
-
Result:Oral bioavailability (87%), T1/2 (1.3 h).
-
Animal Model:Female beagle dogs[3]
-
Dosage:0.3-0.5 mg/kg for i.v.; 0.6-1 mg/kg for oral (Pharmacokinetic Analysis)
-
Administration:Intravenous injection and oral administration
-
Result:Oral bioavailability (51%), T1/2 (1.0 h).
| NCT Number | Sponsor | Condition | Start Date |
Phase
|
|---|---|---|---|---|
| NCT01329991 | Plexxikon| | 2011-05 | PHASE1 |
Chemical Information
-
Appearance Solid
-
Molecular Weight 411.89
-
Formula C20H22ClN7O
-
Color Yellow to orange
-
SMILES
CN1N=CC=C1C2=C(C=CN=C3C4=CC=NN4)C3=NC(N5[C@H](C)COCC5)=C2.[H]Cl
-
Synonyms
BAY 1895344 hydrochloride
-
Shipping
Room temperature in continental US; may vary elsewhere.
-
Storage
4°C, sealed storage, away from moisture
* In solvent : -80°C, 2 years; -20°C, 1 year (sealed storage, away from moisture)
Publications (17)
-
Journal Impact Factor
-
Most Recent
-
Cancer Res
Combined Inactivation of CTPS1 and ATR Is Synthetically Lethal to MYC-Overexpressing Cancer Cells. [Abstract]2022 Mar 15;82(6):1013-1024. PMID: 35022212 -
Nat Commun
X-ray preactivated reversible persistent luminescence enables photodynamic immunotherapy of deep tumors. [Abstract]2026 Mar 21. PMID: 41865031 -
Nat Commun
Stepwise phosphorylation and SUMOylation of PIDD1 drive PIDDosome assembly in response to DNA repair failure. [Abstract]2024 Oct 24;15(1):9195. PMID: 39448602
Elimusertib hydrochloride purchased from MedChemExpress. Usage Cited in: Nat Commun. 2024 Oct 24;15(1):9195. [Abstract]
PIDD1−/− HeLa cells transfected with indicated FLAG-PIDD1 variants with or without ATR inhibitor BAY 1895344 (BAY, 0.75 mM)were harvested at 24 h, immunoprecipitated with anti-PIDD1 pT788 antibody, and analyzed by western blot.
-
Exp Mol Med
Inhibition of GSK3β is synthetic lethal with FHIT loss in lung cancer by blocking homologous recombination repair. [Abstract]2025 Feb;57(1):167-183. PMID: 39762409
Elimusertib hydrochloride purchased from MedChemExpress. Usage Cited in: Exp Mol Med. 2025 Feb;57(1):167-183. [Abstract]
Effects of Elimusertib on p-BRCA1 (s1423), BRCA1, and RAD51 protein levels. The cells were treated with 0.2 μM Elimusertib for 24 h, and Western blotting was used to detect protein expression. GAPDH was used as the internal control. All FHIT-deficient cells are marked in red.
-
Cell Rep Med
2025 May 6:102129. PMID: 40359934
Elimusertib hydrochloride purchased from MedChemExpress. Usage Cited in: Cell Rep Med. 2025 May 6:102129. [Abstract]
Comparison of synergy scores for cisplatin by target drug. The Bliss score was calculated using SynergyFinder to evaluate the synergistic effects of BAY1895344 (0.01 μM; 5 days), AZD7762, EPZ015666, or everolimus in combination with cisplatin across 27 OSCC organoids, comprising 10 normal-like, 8 dense, and 9 grape-like subtypes.
-
Sci Adv
PARP4 ADP-ribosylates PIDD1 to complete a phospho/SUMO/PAR-ylation cascade that orchestrates PIDDosome assembly. [Abstract]2026 May;12(18):eadz9284. PMID: 42054439 -
-
Cancer Lett
2026 Apr 1:642:218300. PMID: 41651400 -
J Med Chem
2024 Feb 22;67(4):2349-2368. PMID: 38299539 -
Biochem Pharmacol
Cytarabine-induced destabilization of MCL1 mRNA and protein triggers apoptosis in leukemia cells. [Abstract]2023 May:211:115494. PMID: 36924905
Elimusertib hydrochloride purchased from MedChemExpress. Usage Cited in: Biochem Pharmacol. 2023 May:211:115494. [Abstract]
Elimusertib (10 μM; 1 h) pretreatment inhibits Ara-C-induced p38 MAPK phosphorylation but does not inhibit AKT dephosphorylation.
-
RSC Adv
Injectable thermosensitive hydrogel co-loading with ATRi and doxorubicin for the treatment of triple-negative breast cancer. [Abstract]2025 Jun 16;15(26):20385-20396. PMID: 40530304 -
EMBO Rep
Tumor acidosis-induced DNA damage response and tetraploidy enhance sensitivity to ATM and ATR inhibitors. [Abstract]2024 Mar;25(3):1469-1489. PMID: 38366255
Elimusertib hydrochloride purchased from MedChemExpress. Usage Cited in: EMBO Rep. 2024 Mar;25(3):1469-1489. [Abstract]
Cell viability assays in HCT116 and HT-29 cancer cells cultured at pH 7.4 or 6.5, and treated with the indicated doses of ATRi Elimusertib (0.03-1 μM) for 72 h.
-
Mol Cell Biol
Kinase Inhibitor-Induced Cell-Type Specific Vacuole Formation in the Absence of Canonical ATG5-Dependent Autophagy Initiation Pathway. [Abstract]2025;45(3):99-115. PMID: 39895059 -
bioRxiv
Glutamine antagonism suppresses tumor growth in adrenocortical carcinoma through inhibition of de novo nucleotide biosynthesis. [Abstract]2025 Sep 29:2025.09.28.674326. PMID: 41256360 -
-
-
Solvent & Solubility
DMSO : 50 mg/mL (121.39 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
H2O : 50 mg/mL (121.39 mM; Need ultrasonic)
Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 2 years; -20°C, 1 year (sealed storage, away from moisture). When stored at -80°C, please use it within 2 years. When stored at -20°C, please use it within 1 year.
* Note: If you choose water as the stock solution, please dilute it to the working solution, then filter and sterilize it with a 0.22 μm filter before use.
Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 2 years; -20°C, 1 year (sealed storage, away from moisture). When stored at -80°C, please use it within 2 years. When stored at -20°C, please use it within 1 year.
* Note: If you choose water as the stock solution, please dilute it to the working solution, then filter and sterilize it with a 0.22 μm filter before use.
Concentration (start) × Volume (start) = Concentration (final) × Volume (final)
Select the appropriate dissolution method based on your experimental animal and administration route.
- For the following dissolution methods, please ensure to first prepare a clear stock solution using an In Vitro approach and then sequentially add co-solvents:
- To ensure reliable experimental results, the clarified stock solution can be appropriately stored based on storage conditions. As for the working solution for In Vivo experiments, it is recommended to prepare freshly and use it on the same day.
- The percentages shown for the solvents indicate their volumetric ratio in the final prepared solution. If precipitation or phase separation occurs during preparation, heat and/or sonication can be used to aid dissolution.
Add each solvent one by one: 10% DMSO 40% PEG300 5% Tween-80 45% Saline
Solubility: ≥ 2.08 mg/mL (5.05 mM); Clear solution
This protocol yields a clear solution of ≥ 2.08 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (20.8 mg/mL) to 400 μL PEG300, and mix evenly; then add 50 μL Tween-80 and mix evenly; then add 450 μL Saline to adjust the volume to 1 mL.
Preparation of Saline: Dissolve 0.9 g sodium chloride in ddH₂O and dilute to 100 mL to obtain a clear Saline solution.
Add each solvent one by one: 10% DMSO 90% (20% SBE-β-CD in Saline)
Solubility: ≥ 2.08 mg/mL (5.05 mM); Clear solution
This protocol yields a clear solution of ≥ 2.08 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (20.8 mg/mL) to 900 μL 20% SBE-β-CD in Saline, and mix evenly.
Preparation of 20% SBE-β-CD in Saline (4°C, storage for one week): 2 g SBE-β-CD powder is dissolved in 10 mL Saline, completely dissolve until clear.
For the following dissolution methods, please prepare the working solution directly:
It is recommended to prepare fresh solutions and use them promptly within a short period of time.
The percentages shown for the solvents indicate their volumetric ratio in the final prepared solution. If precipitation or phase separation occurs during preparation, heat and/or sonication can be used to aid dissolution.
Add each solvent one by one: PBS
Solubility: 100 mg/mL (242.78 mM); Clear solution; Need ultrasonic
Please enter the basic information of animal experiments:
-
-
-
-
Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.
Working solution concentration: 0.22 mg/mL
This product has good water solubility, please refer to the measured solubility data in water/PBS/Saline for details.
Purity & Documentation
-
Data Sheet (283 KB)
-
SDS (252 KB)
- English - EN (252 KB)
- Français - FR (252 KB)
- Deutsch - DE (252 KB)
- Norwegian - NO (252 KB)
- Español - ES (252 KB)
- Swedish - SV (252 KB)
- Italian - IT (252 KB)
- Korean - KR (252 KB)
- Portuguese - PT (252 KB)
-
Handling Instructions (2659 KB)
References
[3]. Ulrich Lücking, et al. Damage Incorporated: Discovery of the Potent, Highly Selective, Orally Available ATR Inhibitor BAY 1895344 with Favorable Pharmacokinetic Properties and Promising Efficacy in Monotherapy and in Combination Treatments in Preclinical Tumor Models. J Med Chem. 2020 Jul 9;63(13):7293-7325. [Content Brief]
Complete Stock Solution Preparation Table
Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 2 years; -20°C, 1 year (sealed storage, away from moisture). When stored at -80°C, please use it within 2 years. When stored at -20°C, please use it within 1 year.
| Optional Solvent | Concentration Solvent Mass | 1 mg | 5 mg | 10 mg | 25 mg |
|---|---|---|---|---|---|
| DMSO / H2O | 1 mM | 2.4278 mL | 12.1392 mL | 24.2783 mL | 60.6958 mL |
| 5 mM | 0.4856 mL | 2.4278 mL | 4.8557 mL | 12.1392 mL | |
| 10 mM | 0.2428 mL | 1.2139 mL | 2.4278 mL | 6.0696 mL | |
| 15 mM | 0.1619 mL | 0.8093 mL | 1.6186 mL | 4.0464 mL | |
| 20 mM | 0.1214 mL | 0.6070 mL | 1.2139 mL | 3.0348 mL | |
| 25 mM | 0.0971 mL | 0.4856 mL | 0.9711 mL | 2.4278 mL | |
| 30 mM | 0.0809 mL | 0.4046 mL | 0.8093 mL | 2.0232 mL | |
| 40 mM | 0.0607 mL | 0.3035 mL | 0.6070 mL | 1.5174 mL | |
| 50 mM | 0.0486 mL | 0.2428 mL | 0.4856 mL | 1.2139 mL | |
| 60 mM | 0.0405 mL | 0.2023 mL | 0.4046 mL | 1.0116 mL | |
| 80 mM | 0.0303 mL | 0.1517 mL | 0.3035 mL | 0.7587 mL | |
| 100 mM | 0.0243 mL | 0.1214 mL | 0.2428 mL | 0.6070 mL |
* Note: If you choose water as the stock solution, please dilute it to the working solution, then filter and sterilize it with a 0.22 μm filter before use.