Nitric Oxide Conjugation Transforms NIR‐II AIEgens Into Potent Hypoxia‐Tolerant Type I Photosensitizers

J Junjun Ni Y Yan Feng J Jianquan Zhang (Guangdong Basic Research Center of Excellence for Aggregate Science, School of Science and Engineering) M Muhammad Muazzam Naseer (Bioinspired Engineering and Biomechanics Center (BEBC) School of Life Science and Technology The Key Laboratory of Biomedical Information Engineering of Ministry of Education Xi'an Jiaotong University Xi'an P. R. China) L Liang Guo (Department of Chemistry) K Kunpeng Feng (Bioinspired Engineering and Biomechanics Center (BEBC) School of Life Science and Technology The Key Laboratory of Biomedical Information Engineering of Ministry of Education Xi'an Jiaotong University Xi'an P. R. China) R Ryan T. K. Kwok (Department of Chemistry, the Hong Kong Branch of Chinese National Engineering Research Center for Tissue Restoration and Reconstruction, Department of Chemical and Biological Engineering, State Key Laboratory of Nervous System Disorders, The Hong Kong University of Science and Technology, Clear Water Bay, Kowloon, Hong Kong SAR 999077, China) J Jacky W. Y. Lam (Department of Chemistry, the Hong Kong Branch of Chinese National Engineering Research Center for Tissue Restoration and Reconstruction, Department of Chemical and Biological Engineering, State Key Laboratory of Nervous System Disorders, The Hong Kong University of Science and Technology, Clear Water Bay, Kowloon, Hong Kong SAR 999077, China) L Lianrui Hu (Shanghai Engineering Research Center of Molecular Therapeutics and New Drug Development, Shanghai Frontiers Science Center of Molecule Intelligent Syntheses, School of Chemistry and Molecular Engineering) X Xiaoran Yin (Department of Oncology The Second Affiliated Hospital of Xi'an Jiaotong University Xi'an P. R. China) G Guorui Jin (Bioinspired Engineering and Biomechanics Center (BEBC) School of Life Science and Technology The Key Laboratory of Biomedical Information Engineering of Ministry of Education Xi'an Jiaotong University Xi'an P. R. China) B Ben Zhong Tang (School of Science and Engineering, Guangdong Basic Research Center of Excellence for Aggregate Science, The Chinese University of Hong Kong (Shenzhen), Longgang, Shenzhen 518172, Guangdong, P. R. China)

Abstract

ABSTRACT Near‐infrared (NIR)‐activated type I photosensitizers (PSs) with aggregation‐induced emission (AIE) properties are highly attractive for photodynamic therapy (PDT) of deep‐seated and inoperable tumors. However, most NIR‐activated AIEgens, especially donor–acceptor–donor (D‐A‐D) benzobisthiadiazole derivatives, are mainly used for bioimaging and photothermal therapy due to their intrinsically small S 1 →S 0 energy gaps (Δ E S1‐S0 ) severely limiting reactive oxygen species (ROS) generation. Here, we present a strategy to convert widely adopted D‐A‐D NIR‐activated AIEgens into NIR‐activated type I PSs by conjugating nitric oxide (NO) to the electron‐donating units. Upon NO conjugation, the resulting compounds NO‐T‐TQT and NO‐2TT‐ o C6B become efficient generators of NIR‐activated hydroxyl radical (•OH), exhibiting a 13.2‐fold and 5.4‐fold increase in superoxide (O 2 •− ) production compared with their parent molecules, respectively. In contrast, T‐TQT, 2TT‐ o C6B, and related analogues produce negligible ROS and no detectable •OH. Mechanistic studies reveal that NO conjugation narrows the singlet‐triplet energy gap, strengthens spin‐orbit coupling to enhance intersystem crossing, optimizes redox potentials to favor electron transfer, and lowering hydrogen atom affinity. NO‐2TT‐ o C6B nanoparticles achieved potent in vitro cytotoxicity and effective in vivo tumor ablation under NIR irradiation. This work establishes a general approach to transform conventional NIR‐activated D‐A‐D AIEgens into high‐performance type I PSs, significantly advancing their clinical potential in PDT.

Article Details

Volume / Issue Vol. 38, Issue 43
Published August 01, 2026
ISSN 0935-9648
Publisher Unknown Publisher

Journal Info

Advanced Materials

Unknown Publisher

ISSN: 0935-9648 Physical Sciences

Authors (12)

J

Junjun Ni

Y

Yan Feng

J

Jianquan Zhang

Guangdong Basic Research Center of Excellence for Aggregate Science, School of Science and Engineering

M

Muhammad Muazzam Naseer

Bioinspired Engineering and Biomechanics Center (BEBC) School of Life Science and Technology The Key Laboratory of Biomedical Information Engineering of Ministry of Education Xi'an Jiaotong University Xi'an P. R. China

L

Liang Guo

Department of Chemistry

K

Kunpeng Feng

Bioinspired Engineering and Biomechanics Center (BEBC) School of Life Science and Technology The Key Laboratory of Biomedical Information Engineering of Ministry of Education Xi'an Jiaotong University Xi'an P. R. China

R

Ryan T. K. Kwok

Department of Chemistry, the Hong Kong Branch of Chinese National Engineering Research Center for Tissue Restoration and Reconstruction, Department of Chemical and Biological Engineering, State Key Laboratory of Nervous System Disorders, The Hong Kong University of Science and Technology, Clear Water Bay, Kowloon, Hong Kong SAR 999077, China

J

Jacky W. Y. Lam

Department of Chemistry, the Hong Kong Branch of Chinese National Engineering Research Center for Tissue Restoration and Reconstruction, Department of Chemical and Biological Engineering, State Key Laboratory of Nervous System Disorders, The Hong Kong University of Science and Technology, Clear Water Bay, Kowloon, Hong Kong SAR 999077, China

L

Lianrui Hu

Shanghai Engineering Research Center of Molecular Therapeutics and New Drug Development, Shanghai Frontiers Science Center of Molecule Intelligent Syntheses, School of Chemistry and Molecular Engineering

X

Xiaoran Yin

Department of Oncology The Second Affiliated Hospital of Xi'an Jiaotong University Xi'an P. R. China

G

Guorui Jin

Bioinspired Engineering and Biomechanics Center (BEBC) School of Life Science and Technology The Key Laboratory of Biomedical Information Engineering of Ministry of Education Xi'an Jiaotong University Xi'an P. R. China

B

Ben Zhong Tang

School of Science and Engineering, Guangdong Basic Research Center of Excellence for Aggregate Science, The Chinese University of Hong Kong (Shenzhen), Longgang, Shenzhen 518172, Guangdong, P. R. China