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CID 2745687 is a reversible, competitive antagonist of the G protein-coupled receptor GPR35, which is activated by kynurenic acid and 2-acyl lysophosphatidic acids. It is expressed predominantly on immune cells, the brain, and in the gastrointestinal tract, and is overexpressed in gastric cancer cells. CID 2745687 blocks activation by the synthetic agonist pamoic acid with a Ki value of 12.8 nM and shows ~57-fold selectivity for GPR35 over the related receptor GPR55.

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  • Methyl 1-(2,4-Difluoro-phenyl)-5-((4-tert-butyl-thiosemicarbazono)methyl)-1H-pyrazole-4-carboxylate;264233-05-8

    Cas No: 264233-05-8

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  • methyl 5-[(E)-(tert-butylcarbamothioylhydrazinylidene)methyl]-1-(2,4-difluorophenyl)pyrazole-4-carboxylate

    Cas No: 264233-05-8

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  • 264233-05-8 Structure
  • Basic information

    1. Product Name: CID 2745687
    2. Synonyms: Methyl 1-(2,4-Difluoro-phenyl)-5-((4-tert-butyl-thioseMicarbazono)Methyl)-1H-pyrazole-4-carboxylate;methyl 5-[(E)-(tert-butylcarbamothioylhydrazono)methyl]-1-(2,4-difluorophenyl)pyrazole-4-carboxylate
    3. CAS NO:264233-05-8
    4. Molecular Formula: C17H19F2N5O2S
    5. Molecular Weight: 395.4268664
    6. EINECS: N/A
    7. Product Categories: Aromatics, Diagnostic and Labeling Agents, Pharmaceuticals, Intermediates & Fine Chemicals
    8. Mol File: 264233-05-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: Soluble in DMSO
    9. CAS DataBase Reference: CID 2745687(CAS DataBase Reference)
    10. NIST Chemistry Reference: CID 2745687(264233-05-8)
    11. EPA Substance Registry System: CID 2745687(264233-05-8)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 264233-05-8(Hazardous Substances Data)

264233-05-8 Usage

Uses

Used in Immune System Regulation:
CID 2745687 is used as a GPR35 antagonist for immune system regulation, potentially modulating the activity of immune cells that express GPR35.
Used in Gastrointestinal System Regulation:
CID 2745687 is used as a GPR35 antagonist for gastrointestinal system regulation, potentially influencing the function of the gastrointestinal tract where GPR35 is expressed.
Used in Anticancer Applications:
CID 2745687 is used as a GPR35 antagonist for targeting gastric cancer cells that overexpress GPR35, potentially inhibiting their growth and progression by blocking GPR35 activation.

in vitro

previous study indicated that both cid-2745687 and ml-145 could competitively inhibit the effects of cromolyn disodium and zaprinast (two agonists sharing an overlapping binding site) on human gpr35. in contrast, though ml-145 antagonized the effects of pamoate competitively, cid-2745687 showed a noncompetitive fashion. additionally, neither ml-145 nor cid-2745687 was able to antagonize the agonist effects at rodent ortholog of gpr35 [1].

in vivo

to test whether gpr35 contributes to the metabolic effect of zaprinast, the retina from cngb1/ mice was preincubated with a gpr35 antagonist, cid-2745687, followed by an additional zaprinast treatment. results showed that cid-2745687 did not block the effect of zaprinast on glutamate and aspartate. moreover, pamoic acid, the gpr35 agonist, did not change aspartate or glutamate levels [1].

references

[1] jenkins l,harries n,lappin je,mackenzie ae,neetoo-isseljee z,southern c,mciver eg,nicklin sa,taylor dl,milligan g. antagonists of gpr35 display high species ortholog selectivity and varying modes of action. j pharmacol exp ther.2012 dec;343(3):683-95. [2] du j,cleghorn wm,contreras l,lindsay k,rountree am,chertov ao,turner sj,sahaboglu a,linton j,sadilek m,satrústegui j,sweet ir,paquet-durand f,hurley jb. inhibition of mitochondrial pyruvate transport by zaprinast causes massive accumulation of aspartate at the expense of glutamate in the retina. j biol chem.2013 dec 13;288(50):36129-40.

Check Digit Verification of cas no

The CAS Registry Mumber 264233-05-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,6,4,2,3 and 3 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 264233-05:
(8*2)+(7*6)+(6*4)+(5*2)+(4*3)+(3*3)+(2*0)+(1*5)=118
118 % 10 = 8
So 264233-05-8 is a valid CAS Registry Number.

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