Structure of SR1001
CAS No.: 1335106-03-0
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The BI-3802 was designed by Boehringer Ingelheim and could be obtained free of charge through the Boehringer Ingelheim open innovation portal opnMe.com, associated with its negative control.
SR1001 is a selective RORα and RORγ inverse agonist and inhibits TH17 cell differentiation and function.
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Batch number can be found on the product's label following the word 'Batch'.
Search for reports by entering the product batch number.
Batch number can be found on the product's label following the word 'Batch'.
Search for reports by entering the product batch number.
Batch number can be found on the product's label following the word 'Batch'.
Search for reports by entering the product batch number.
Batch number can be found on the product's label following the word 'Batch'.
Search for reports by entering the product batch number.
Batch number can be found on the product's label following the word 'Batch'.
CAS No. : | 1335106-03-0 |
Formula : | C15H13F6N3O4S2 |
M.W : | 477.40 |
SMILES Code : | CC(NC1=NC(C)=C(S(=O)(NC2=CC=C(C(C(F)(F)F)(O)C(F)(F)F)C=C2)=O)S1)=O |
MDL No. : | MFCD23160036 |
InChI Key : | OZBSSKGBKHOLGA-UHFFFAOYSA-N |
Pubchem ID : | 44241473 |
GHS Pictogram: |
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Signal Word: | Warning |
Hazard Statements: | H302-H319 |
Precautionary Statements: | P305+P351+P338 |
In Vitro:
Cell Line
|
Concentration | Treated Time | Description | References |
Primary mouse keratinocytes (MKCs) | 10 µM | 20 hours | Evaluate the effect of SR1001 on MC903-induced Tslp expression, SR1001 showed moderate suppression of Tslp expression in vitro | J Invest Dermatol. 2017 Dec;137(12):2523-2531 |
Human peripheral blood mononuclear cells (hPBMCs) | 5 µM | 24 hours | To evaluate the effect of SR1001 on IL-17 expression in human PBMCs, results showed that SR1001 inhibited IL-17 expression. | Nature. 2011 Apr 28;472(7344):491-4 |
EL4 cells | 10 µM | 24 hours | To evaluate the effect of SR1001 on IL-17A mRNA expression, results showed that SR1001 suppressed Il17a mRNA expression, and this suppression was dependent on ROR α/ROR γ. | Nature. 2011 Apr 28;472(7344):491-4 |
HepG2 cells | 10 µM | 24 hours | Suppression of ENHO gene expression | Mol Metab. 2018 Feb;8:51-64 |
Pancreatic acinar AR42J cells | 15 μg/ml | 24 hours | To investigate the effect of SR1001 on pancreatic acinar cell apoptosis, results showed that SR1001 significantly reduced cell apoptosis. | Heliyon. 2023 Sep 18;9(9):e20118 |
CD4+ T cells | 15 μg/ml | 24 hours | To investigate the effect of SR1001 on Th17 cell differentiation, results showed that SR1001 significantly downregulated Th17 cell differentiation. | Heliyon. 2023 Sep 18;9(9):e20118 |
Primary mouse keratinocytes (MKCs) | 10 µM | 4 hours | Evaluate the effect of SR1001 on TPA-induced inflammatory cytokine expression, SR1001 did not significantly block TPA-induced cytokine expression | J Invest Dermatol. 2017 Dec;137(12):2523-2531 |
Splenocytes | 5 µM | 5 days | To evaluate the effect of SR1001 on T H17 cell differentiation, results showed that SR1001 inhibited the mRNA expression of Il17a, Il17f, Il21, and Il22. | Nature. 2011 Apr 28;472(7344):491-4 |
Human monocyte-derived macrophages | 10 µM | 7 days | SR1001 treatment reduced the expression of the BMAL1 repressor REV ERBα in M1 macrophages and showed a tendency towards reduced viability of the cells. In M2 macrophages, RORβ levels significantly increased. | Front Immunol. 2024 May 28;15:1408772 |
In Vivo:
Species
|
Animal Model
|
Administration | Dosage | Frequency | Description | References |
C57BL/6J mice | MC903-induced atopic dermatitis-like disease model and TPA-induced acute irritant dermatitis model | Topical application | 0.6 mg (50 mM) | Once daily for 11 days (AD model) or single dose followed by 26-hour observation (acute dermatitis model) | Evaluate the anti-inflammatory effects of SR1001, SR1001 significantly reduced skin inflammation induced by MC903 and TPA, decreasing inflammatory cell infiltration and cytokine expression | J Invest Dermatol. 2017 Dec;137(12):2523-2531 |
Male C57BL/6J mice | High cholesterol diet model | Intraperitoneal injection | 100 mg/kg | Twice daily for 21 days | High cholesterol diet suppressed hepatic Enho expression, SR1001 further suppressed expression | Mol Metab. 2018 Feb;8:51-64 |
Mice | Depression-like behavior models | Intraperitoneal injection | 125 µg | Once daily, starting one day before Th17 cell transfer and continued throughout the experiment | Inhibition of RORγT to reduce Th17 cell differentiation, thereby decreasing depression-like behavior | Biol Psychiatry. 2013 Apr 1;73(7):622-30 |
Mice | Experimental autoimmune encephalomyelitis (EAE) model | Intraperitoneal injection (i.p.) | 25 mg/kg | Twice daily, for the duration of the study | To evaluate the effect of SR1001 on the EAE model, results showed that SR1001 delayed the onset and clinical severity of EAE and suppressed the mRNA expression of Il17a, Il21, and Il22 in the spinal cord. | Nature. 2011 Apr 28;472(7344):491-4 |
Wistar rats | Chronic restraint stress model | Intraperitoneal injection | 25 mg/kg | Daily for 28 days | SR1001 treatment significantly ameliorated CRS-induced depressive-like behavior in the sucrose preference test, forced swim test, and novelty-suppressed feeding test. Additionally, SR1001 reduced the expression levels of IL-6, IL-17, and IL-22 in serum. | J Neuroinflammation. 2022 Jul 14;19(1):186 |
BALB/c mice | House dust mite (HDM)-induced allergic airway inflammation model | Intraperitoneal injection | 25 mg/kg | Twice daily, for a total of five times | SR1001 significantly reduced the proportion of proinflammatory Mo-AMs in the bronchoalveolar lavage fluid (BALF) of mice and decreased immune cell infiltration and goblet cell hyperplasia in lung tissue. | Front Immunol. 2024 May 28;15:1408772 |
Mice | LDL-R−/− mice | Intraperitoneal injection | 25 mg/kg | Twice daily for one month | SR1001 treatment significantly reduced plaque formation, decreased plasma low-density lipoprotein (LDL) levels without affecting high-density lipoprotein (HDL). Additionally, SR1001 induced an anti-atherogenic immune profile characterized by a reduction in Th17 cells and an increase in Treg and Th2 cells. | Mol Metab. 2016 Jul 25;5(10):997-1005 |
Mice | LDL-R−/− mice | Intraperitoneal injection | 25 mg/kg | Twice daily for one month | SR1001 treatment significantly decreased plaque formation, reduced plasma LDL levels without affecting HDL, and modulated cholesterol metabolism by increasing intestinal cholesterol excretion. Additionally, SR1001 induced an anti-atherogenic immune profile characterized by a reduction in Th17 cells and an increase in Treg and Th2 cells. | Mol Metab. 2016 Jul 25;5(10):997-1005 |
C57BL/6 mice | CLP-induced sepsis-associated pancreatic injury model | Intraperitoneal injection | 25 mg/kg | Once daily for three days | To investigate the protective effect of SR1001 on sepsis-associated pancreatic injury, results showed that SR1001 significantly alleviated pancreatic injury and inhibited the RhoA/ROCK1 pathway. | Heliyon. 2023 Sep 18;9(9):e20118 |
Mice | STZ-induced diabetic mouse model | Subcutaneous injection | 5 μM/100 μL | Once per week for 2 months or 8 months | SR1001 treatment significantly reduced retinal inflammation, oxidative stress, and capillary degeneration in diabetic mice, and decreased leukocyte adhesion and retinal endothelial cell death. | Int J Mol Sci. 2020 May 17;21(10):3547 |
Tags: SR1001 | SR 1001 | SR-1001 | RAR-related orphan receptor | inhibitor | 1335106-03-0 |
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P313 | Get medical advice/attention. |
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P315 | Get immediate medical advice/attention. |
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P322 | |
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P350 | Gently wash with plenty of soap and water. |
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P376 | Stop leak if safe to do so. Oxidising gases (section 2.4) 1 |
P377 | Leaking gas fire: Do not extinguish, unless leak can be stopped safely. |
P378 | |
P380 | Evacuate area. |
P381 | Eliminate all ignition sources if safe to do so. |
P390 | Absorb spillage to prevent material damage. |
P391 | Collect spillage. Hazardous to the aquatic environment |
P301 + P310 | IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. |
P301 + P312 | IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. |
P301 + P330 + P331 | IF SWALLOWED: Rinse mouth. Do NOT induce vomiting. |
P302 + P334 | IF ON SKIN: Immerse in cool water/wrap in wet bandages. |
P302 + P350 | IF ON SKIN: Gently wash with plenty of soap and water. |
P303 + P361 + P353 | IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. |
P304 + P312 | IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell. |
P304 + P340 | IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. |
P304 + P341 | IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing. |
P305 + P351 + P338 | IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. |
P306 + P360 | IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes. |
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P308 + P313 | IF exposed or concerned: Get medical advice/attention. |
P309 + P311 | IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician. |
P332 + P313 | IF SKIN irritation occurs: Get medical advice/attention. |
P333 + P313 | IF SKIN irritation or rash occurs: Get medical advice/attention. |
P335 + P334 | Brush off loose particles from skin. Immerse in cool water/wrap in wet bandages. |
P337 + P313 | IF eye irritation persists: Get medical advice/attention. |
P342 + P311 | IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician. |
P370 + P376 | In case of fire: Stop leak if safe to Do so. |
P370 + P378 | In case of fire: |
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P370 + P380 + P375 | In case of fire: Evacuate area. Fight fire remotely due to the risk of explosion. |
P371 + P380 + P375 | In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion. |
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H200 | Unstable explosive |
H201 | Explosive; mass explosion hazard |
H202 | Explosive; severe projection hazard |
H203 | Explosive; fire, blast or projection hazard |
H204 | Fire or projection hazard |
H205 | May mass explode in fire |
H220 | Extremely flammable gas |
H221 | Flammable gas |
H222 | Extremely flammable aerosol |
H223 | Flammable aerosol |
H224 | Extremely flammable liquid and vapour |
H225 | Highly flammable liquid and vapour |
H226 | Flammable liquid and vapour |
H227 | Combustible liquid |
H228 | Flammable solid |
H229 | Pressurized container: may burst if heated |
H230 | May react explosively even in the absence of air |
H231 | May react explosively even in the absence of air at elevated pressure and/or temperature |
H240 | Heating may cause an explosion |
H241 | Heating may cause a fire or explosion |
H242 | Heating may cause a fire |
H250 | Catches fire spontaneously if exposed to air |
H251 | Self-heating; may catch fire |
H252 | Self-heating in large quantities; may catch fire |
H260 | In contact with water releases flammable gases which may ignite spontaneously |
H261 | In contact with water releases flammable gas |
H270 | May cause or intensify fire; oxidizer |
H271 | May cause fire or explosion; strong oxidizer |
H272 | May intensify fire; oxidizer |
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H281 | Contains refrigerated gas; may cause cryogenic burns or injury |
H290 | May be corrosive to metals |
Health hazards | |
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H300 | Fatal if swallowed |
H301 | Toxic if swallowed |
H302 | Harmful if swallowed |
H303 | May be harmful if swallowed |
H304 | May be fatal if swallowed and enters airways |
H305 | May be harmful if swallowed and enters airways |
H310 | Fatal in contact with skin |
H311 | Toxic in contact with skin |
H312 | Harmful in contact with skin |
H313 | May be harmful in contact with skin |
H314 | Causes severe skin burns and eye damage |
H315 | Causes skin irritation |
H316 | Causes mild skin irritation |
H317 | May cause an allergic skin reaction |
H318 | Causes serious eye damage |
H319 | Causes serious eye irritation |
H320 | Causes eye irritation |
H330 | Fatal if inhaled |
H331 | Toxic if inhaled |
H332 | Harmful if inhaled |
H333 | May be harmful if inhaled |
H334 | May cause allergy or asthma symptoms or breathing difficulties if inhaled |
H335 | May cause respiratory irritation |
H336 | May cause drowsiness or dizziness |
H340 | May cause genetic defects |
H341 | Suspected of causing genetic defects |
H350 | May cause cancer |
H351 | Suspected of causing cancer |
H360 | May damage fertility or the unborn child |
H361 | Suspected of damaging fertility or the unborn child |
H361d | Suspected of damaging the unborn child |
H362 | May cause harm to breast-fed children |
H370 | Causes damage to organs |
H371 | May cause damage to organs |
H372 | Causes damage to organs through prolonged or repeated exposure |
H373 | May cause damage to organs through prolonged or repeated exposure |
Environmental hazards | |
Code | Phrase |
H400 | Very toxic to aquatic life |
H401 | Toxic to aquatic life |
H402 | Harmful to aquatic life |
H410 | Very toxic to aquatic life with long-lasting effects |
H411 | Toxic to aquatic life with long-lasting effects |
H412 | Harmful to aquatic life with long-lasting effects |
H413 | May cause long-lasting harmful effects to aquatic life |
H420 | Harms public health and the environment by destroying ozone in the upper atmosphere |
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