Home Angiogenesis PI3K inhibitor IPI-145 (Duvelisib)

연구용

IPI-145 (Duvelisib) PI3K δ/γ Inhibitor

제품 번호: S7028

Duvelisib (IPI-145, INK1197) is a novel and selective PI3K δ/γ inhibitor with Ki and IC50 of 23 pM/243 pM and 1 nM/50 nM in cell-free assays, highly selective for PI3K δ/γ than other protein kinases. Phase 3.
IPI-145 (Duvelisib) PI3K inhibitor Chemical Structure

화학 구조

분자량: 416.86

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품질 관리 (Quality Control)

배치: 순도: 99.96%
99.96

세포 배양, 처리 및 작업 농도
(Cell Culture, Treatment & Working Concentration)

세포주 분석 유형 농도 배양 시간 제형 활성 설명 PMID
Jurkat Proliferation assay 3 days Antiproliferative activity against human Jurkat cells after 3 days by CellTiter-Glo assay, IC50=1.9 Μm 27774127
MOLT4 Proliferation assay 3 days Antiproliferative activity against human MOLT4 cells after 3 days by CellTiter-Glo assay, IC50=2.3 μM 27774127
MV4-11 Proliferation assay 3 days Antiproliferative activity against human MV4-11 cells after 3 days by CellTiter-Glo assay, IC50=4.4 μM 27774127
MOLM14 Proliferation assay 3 days Antiproliferative activity against human MOLM14 cells after 3 days by CellTiter-Glo assay, IC50=1.2 μM 27774127
Loucy Proliferation assay 3 days Antiproliferative activity against human Loucy cells after 3 days by CellTiter-Glo assay, IC50=0.98 μM 27774127
JURKAT Function assay 0.1, 1.0, and 9.0 μM IPI145 was able to inhibit Akt and S6 phosphorylation and modestly affected growth in JURKAT 30970263
MOLT3 Function assay 0.1, 1.0, and 9.0 μM IPI145 was able to inhibit Akt and S6 phosphorylation but barely affected the growth of MOLT3 T-ALL 30970263
Raji32 Function assay 1 μM effectively impaired the phosphorylation of Akt 30584254
Ramos460 Function assay 1 μM effectively impaired the phosphorylation of Akt 30584254
HBL-1 Growth inhibition assay GI50=5.3 μM 30067771
OCI-Ly3 Growth inhibition assay GI50=3.7 μM 30067771
TMD-8 Growth inhibition assay GI50=0.0005 μM 30067771
U-2932 Growth inhibition assay GI50=1.8 μM 30067771
Farage Growth inhibition assay GI50=0.04 μM 30067771
SU-DHL-10 Growth inhibition assay GI50=2.4 μM 30067771
SU-DHL-4 Growth inhibition assay GI50=0.2 μM 30067771
Karpas-422 Growth inhibition assay GI50=0.1 μM 30067771
DOHH-2 Growth inhibition assay GI50=0.05 μM 30067771
WSU-NHL Growth inhibition assay GI50=0.008 μM 30067771
Jeko-1 Growth inhibition assay GI50=1.3 μM 30067771
Mino Growth inhibition assay GI50=3.4 μM 30067771
NCI-H929 Growth inhibition assay GI50=1 μM 30067771
HH Growth inhibition assay GI50=0.01 μM 30067771
BJAB Cell viability assay 0.1, 1, 5 μM 48 and 72 h inhibited cell growth 29522278
LCL Cell viability assay 0.1, 1, 5 μM 48 and 72 h inhibited cell growth 29522278
insect cells Function assay 5 mins Inhibition of recombinant human C-terminal His6-tagged p110gamma expressed in insect cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin layer chromatographic method, IC50 = 0.1 μM. ChEMBL
Sf21 Function assay 5 mins Inhibition of N-terminal His6-tagged recombinant full-length human p110delta/untagged recombinant full length p85alpha expressed in baculovirus infected Sf21 cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin l, IC50 = 0.1 μM. ChEMBL
splenic B Antiproliferative assay 30 mins Antiproliferative activity against Balb/c mouse splenic B cells preincubated for 30 mins followed by LPS or F(ab')2 donkey anti-mouse IgM and recombinant mouse IL4 stimulation measured after 72 hrs by Alamar Blue reduction assay, EC50 = 0.1 μM. ChEMBL
Sf21 Function assay 5 mins Inhibition of N-terminal His6-tagged recombinant full-length human p110beta/untagged recombinant full length p85alpha expressed in baculovirus infected Sf21 cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin la, IC50 = 1 μM. ChEMBL
Sf21 Function assay 5 mins Inhibition of N-terminal His6-tagged recombinant full-length human p110alpha/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf21 cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by , IC50 = 10 μM. ChEMBL
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화학 정보, 보관 및 안정성 (Chemical Information, Storage & Stability)

분자량 416.86 화학식

C22H17ClN6O

 보관 (수령일로부터)
CAS 번호 1201438-56-3 SDF 다운로드 원액 보관

동의어 INK1197 Smiles CC(C1=CC2=C(C(=CC=C2)Cl)C(=O)N1C3=CC=CC=C3)NC4=NC=NC5=C4NC=N5

용해도 (Solubility)

In vitro
배치:

DMSO : 83 mg/mL (199.1 mM)
(수분으로 오염된 DMSO는 용해도를 감소시킬 수 있습니다. 신선하고 무수 DMSO를 사용하십시오.)

Water : Insoluble

Ethanol : Insoluble

몰농도 계산기

질량 농도 부피 분자량
희석 계산기 분자량 계산기

In vivo
배치:

생체 내 제형 계산기 (투명한 용액)

1단계: 아래 정보 입력 (권장: 실험 중 손실을 고려하여 추가 동물 포함)

mg/kg g μL

2단계: 생체 내 제형 입력 (이것은 계산기일 뿐 제형이 아닙니다. 용해도 섹션에 생체 내 제형이 없는 경우 먼저 당사에 문의하십시오.)

% DMSO % % Tween 80 % ddH2O
%DMSO %

계산 결과:

작업 농도: mg/ml;

DMSO 원액 준비 방법: mg 약물 사전 용해 μL DMSO ( 원액 농도 mg/mL, 농도가 해당 약물 배치의 DMSO 용해도를 초과하는 경우 먼저 당사에 문의하십시오. )

생체 내 제형 준비 방법: 취하다 μL DMSO 원액, 다음 추가μL PEG300, 혼합하고 투명하게 한 다음 추가μL Tween 80, 혼합하고 투명하게 한 다음 추가 μL ddH2O, 혼합하고 투명하게 합니다.

생체 내 제형 준비 방법: 취하다 μL DMSO 원액, 다음 추가 μL 옥수수 기름, 혼합하고 투명하게 합니다.

참고: 1. 다음 용매를 추가하기 전에 액체가 투명한지 확인하십시오.
2. 용매를 순서대로 추가해야 합니다. 다음 용매를 추가하기 전에 이전 추가에서 얻은 용액이 투명한 용액인지 확인해야 합니다. 와동, 초음파 또는 뜨거운 물 중탕과 같은 물리적 방법을 사용하여 용해를 도울 수 있습니다.

작용 메커니즘 (Mechanism of Action)

Targets/IC50/Ki
PI3Kδ
(Cell-free assay)
23 pM(Ki)
PI3Kβ
(Cell-free assay)
1564 pM(Ki)
PI3Kγ
(Cell-free assay)
243 pM(Ki)
시험관 내(In vitro)

Duvelisib (IPI-145) suppresses murine/human B-cell proliferation with EC50 of 0.5 nM/0.5 nM and also inhibits human T-cell proliferation with EC50 of 9.5 nM.

생체 내(In vivo)

Duvelisib (IPI-145) (10 mg/kg, p.o.) shows well pharmacokinetics with Cmax and AUC of 390 ng/mL and 137 ng•h/mL in mouse and rat. It is active in murine DTH model with ~50% ear swelling and demonstrates dose-dependent effect in rat collagen induced arthritis (CIA) model. This compound prevents inflammation and protects joint bone and cartilage in the rat CIA model. It (10 mg/kg, QD) also demonstrates activity in rat adjuvant induced polyarthritis model.

참조

적용 분야 (Applications)

방법 바이오마커 이미지 PMID
Western blot PI3Kγ / PI3Kδ p-AKT / AKT / p-MAPK / MAPK
S7028-WB2
29522278

임상시험 정보 (Clinical Trial Information)

(데이터 출처 https://clinicaltrials.gov, 업데이트 날짜 2024-05-22)

NCT 번호 모집 조건 스폰서/협력자 시작일 단계
NCT02307461 Completed
Healthy
SecuraBio
 November 2014 Phase 1
NCT02095587 Completed
Hepatic Impairment
SecuraBio
 March 2014 Phase 1
NCT01947777 Completed
Healthy
SecuraBio
 October 2013 Phase 1
NCT01925911 Completed
Healthy
SecuraBio
 August 2013 Phase 1
NCT01836861 Completed
Healthy
SecuraBio
 March 2013 Phase 1
NCT01549106 Completed
Healthy Volunteers
SecuraBio
 August 2011 Phase 1

자주 묻는 질문 (Frequently Asked Questions)

질문 1:
Whether it is a mixture of two chiral forms, and if not, which form is this compound?

답변:
Its S form is S7028.