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安全和法规

916684

A1V2PF2-NHEt-C₁₀-NH₂

Name: A1V2PF2-NHEt-C<SUB>10</SUB>-NH<SUB>2</SUB>
Brand: ALDRICH

≥95%

别名:

(S)-1-((S)-2-((S)-2-((10-Aminodecyl)amino)propanamido)-2-cyclohexylacetyl)-N-((S)-1-(ethylamino)-3-(4-fluorophenyl)-1-oxopropan-2-yl)pyrrolidine-2-carboxamide, AVP conjugate for IAP-mediated degrader development" to "AVP conjugate for IAP-mediated protein degrader development, SNIPER building block

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About This Item

经验公式（希尔记法）:

C₃₇H₆₁FN₆O₄

分子量:

672.92

MDL编号:

MFCD33021729

UNSPSC代码:

41116105

NACRES:

NA.22

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Sigma-Aldrich

917710

A1V1PF2-OEt

Sigma-Aldrich

719803

碳纳米纤维

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AB3094

抗促食欲素-2受体抗体

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M6182

巯基丁二酸

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930164

六氟磷酸锂溶液

Sigma-Aldrich

544833

氧化铝

Sigma-Aldrich

SML1682

CDN1163

Sigma-Aldrich

719781

碳纳米纤维

Sigma-Aldrich

8.14894

聚乙烯醇，完全水解

Sigma-Aldrich

SML0837

FAK 抑制剂 14

ligand

A1V2PF2

质量水平

100

方案

≥95%

表单

powder

反应适用性

reactivity: carboxyl reactive
reagent type: ligand-linker conjugate

官能团

amine

储存温度

2-8°C

SMILES字符串

C[C@H](NCCCCCCCCCCN)C(N[C@H](C(N1CCC[C@H]1C(N[C@H](C(NCC)=O)CC2=CC=C(C=C2)F)=O)=O)C3CCCCC3)=O

InChI

1S/C37H61FN6O4/c1-3-40-35(46)31(26-28-19-21-30(38)22-20-28)42-36(47)32-18-15-25-44(32)37(48)33(29-16-11-10-12-17-29)43-34(45)27(2)41-24-14-9-7-5-4-6-8-13-23-39/h19-22,27,29,31-33,41H,3-18,23-26,39H2,1-2H3,(H,40,46)(H,42,47)(H,43,45)/t27-,31-,32-,33-/m0/s1

InChI key

HWOUYPPQDSELDI-MKKRQWMVSA-N

应用

Protein degrader building block A1V2PF2-NHEt-C₁₀-NH₂ enables the synthesis of molecules for targeted protein degradation and SNIPER (specific and non-genetic inhibitor of apoptosis protein (IAP)-dependent protein erasers) technology. Developed in partnership with ComInnex, this conjugate contains an in silico-derived IAP-recruiting ligand, an alkyl-chain crosslinker, and a pendant amine for reactivity with an acid on a target warhead. Because even slight alterations in ligands and crosslinkers can affect ternary complex formation between the target, E3 ligase, and protein degrader, many analogs are prepared to screen for optimal target degradation. When used with other protein degrader building blocks with a terminal amine, including CRBN and VHL targeted, parallel synthesis can be used to more quickly generate SNIPER and PROTAC^® degrader libraries that feature variation in crosslinker length, composition, and E3 ligase ligand. Learn more about the novel IAP ligands generated through virtual screening of AVP mimetics in our Technology Spotlight.

Building blocks in this series:
916714 A1V2PF2-NHEt
917931 A1V2PF2-NHEt-C₆-NH₂
916684 A1V2PF2-NHEt-C₁₀-NH₂
916935 A1V2PF2-NHEt-PEG₁-NH₂
917192 A1V2PF2-NHEt-PEG₃-NH₂

Technology Spotlight: Degrader Building Blocks with Inhibitor of Apoptosis Protein (IAP) In Silico-Derived Ligands

其他说明

In Vivo Knockdown of Pathogenic Proteins via Specific and Nongenetic Inhibitor of Apoptosis Protein (IAP)-dependent Protein Erasers (SNIPERs)

SNIPERs−Hijacking IAP activity to induce protein degradation

E3 Ligase Ligands for PROTACs: How They Were Found and How to Discover New Ones

法律信息

PROTAC is a registered trademark of Arvinas Operations, Inc., and is used under license

储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

法规信息

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SNIPERs-Hijacking IAP activity to induce protein degradation.

Mikihiko Naito et al.

Drug discovery today. Technologies, 31, 35-42 (2019-06-16)

The induction of protein degradation by chimeric small molecules represented by proteolysis-targeting chimeras (PROTACs) is an emerging approach for novel drug development. We have developed a series of chimeric molecules termed specific and non-genetic inhibitor of apoptosis protein (IAP)-dependent protein

Nobumichi Ohoka et al.

The Journal of biological chemistry, 292(11), 4556-4570 (2017-02-06)

Many diseases, especially cancers, result from aberrant or overexpression of pathogenic proteins. Specific inhibitors against these proteins have shown remarkable therapeutic effects, but these are limited mainly to enzymes. An alternative approach that may have utility in drug development relies

E3 Ligase Ligands for PROTACs: How They Were Found and How to Discover New Ones.

Tasuku Ishida et al.

SLAS discovery : advancing life sciences R & D, 26(4), 484-502 (2020-11-05)

Bifunctional degrader molecules, also called proteolysis-targeting chimeras (PROTACs), are a new modality of chemical tools and potential therapeutics to understand and treat human disease. A required PROTAC component is a ligand binding to an E3 ubiquitin ligase, which is then joined to another ligand binding to a protein to

商品

Degrader Building Blocks with IAP In Silico-Derived Ligands

Targeted protein degradation reduces disease-relevant proteins in cells using small molecules, hijacking endogenous proteolysis systems.

Accelerating Protein Degrader Discovery with IAP

Plate of 80 ligands against E3 ligase IAP designed by ComInnex; allows creation of bifunctional targeted protein degraders or molecular glues.

Degrader Building Blocks for Targeted Protein Degradation

Protein Degrader Building Blocks are a collection of crosslinker-E3 ligand conjugates with a pendant functional group for covalent linkage to a target ligand.

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A1V2PF2-NHEt-C10-NH2

≥95%

About This Item

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属性

ligand

质量水平

方案

表单

反应适用性

官能团

储存温度

SMILES字符串

InChI

InChI key

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说明

应用

其他说明

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储存分类代码

WGK

闪点(°F)

闪点(°C)

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文件

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A1V2PF2-NHEt-C₁₀-NH₂