Katariya, Ashishkumar P Shirsath, Prakash D Narode, Hanuman Gaikwad, Pravinkumar B Kadam, Gajanan G Katariya, Maya V Deshmukh, Satish U
Published in
Molecular diversity
An efficient and green strategy for the regioselective synthesis of highly functionalized pyranopyrazole via one-pot condensation of 3-methyl-1-phenyl-5-pyrazolone or EAA and hydrazine hydrate, substituted aromatic aldehydes with NMSM [(E)-N-Methyl-1-(methylthio)-2-nitro-ethenamine] in the existence of IL [(EMIM)Ac] as catalyst with solvent-free co...
Hua, Yi Luo, Lin Qiu, Haodi Huang, Dingfang Zhao, Yang Liu, Haichun Lu, Tao Chen, Yadong Zhang, Yanmin Jiang, Yulei
...
Published in
Molecular diversity
Kinase plays a significant role in various disease signaling pathways. Due to the highly conserved sequence of kinase family members, understanding the selectivity profile of kinase inhibitors remains a priority for drug discovery. Previous methods for kinase selectivity identification use biochemical assays, which are very useful but limited by th...
Oliaei, Seyyed Sajjad Habibi, Davood Heydari, Somayyeh Karamian, Roya Ghasemian Sorboni, Shokufeh
Published in
Molecular diversity
Several attempts for preparation of 4,4'-(2-thioxoimidazolidine-1,3-diyl)bis(butane-1-sulfonic acid) were not successful despite taking 2 mmol of 1,4-butane sultone in reaction with 1 mmol of imidazolidine-2-thione. Instead, 4-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)butyl hydrogen sulfite (DISBHS) was prepared unexpectedly, characterized and used for...
Abbasi, Mohammad Nowrouzi, Najmeh Sajedinia, Sara
Published in
Molecular diversity
A one-pot, efficient oxidative-condensation process for constructing both 4-alkyl and 4-aryl-5-(arylthio) thiazol-2-amines using DMSO/I2 is introduced. In this procedure, methyl ketones, thiourea, DMSO, and thiols are reacted together in the presence of molecular I2 at 80 °C simply to produce 4-alkyl or aryl-5-(arylthio)thiazol-2-amines due to form...
Hassan, Syed Shah Shams, Rida Camps, Ihosvany Basharat, Zarrin Sohail, Saman Khan, Yasmin Ullah, Asad Irfan, Muhammad Ali, Javed Bilal, Muhammad
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Published in
Molecular diversity
Burkholderia cepacia complex (BCC) is a group of gram-negative bacteria composed of at least 20 different species that cause diseases in plants, animals as well as humans (cystic fibrosis and airway infection). Here, we analyzed the proteomic data of 47 BCC strains by classifying them in three groups. Phylogenetic analyses were performed followed b...
Dhonnar, Sunil L Jagdale, Bapu S Adole, Vishnu A Sadgir, Nutan V
Published in
Molecular diversity
A new series of 1,3,5-trisubstituted 2-pyrazoline derivatives (3a-l) are synthesized in good to excellent yields from the corresponding chalcones (1a-h) and acid hydrazides (2a-e) in polyethylene glycol-400 (PEG-400) as a green reaction medium. The newly synthesized 2-pyrazoline derivatives are screened for their antibacterial and antifungal activi...
Zhu, Chenghao Zhang, Zhengru Wang, Shangtao Sun, Zhirong
Published in
Molecular diversity
This study analysed the pharmacological mechanism of Gastrodiae Rhizoma, Lycii Fructus, and Ziziphi Spinosae Semen in sedation and tranquillising mind using network pharmacology methods. The findings of this study aimed to serve as a reference for the development of novel drugs and the clinical expansion and application of traditional Chinese medic...
Murali, Maneesha Nair, Bhagyalakshmi Vishnu, V R Aneesh, T P Nath, Lekshmi R
Published in
Molecular diversity
Nimbamritadi Panchatiktam Kashayam (NPK) is an ayurvedic formulation composed of ingredients with potent anti-viral activities. We studied the interaction energy of 144 phytoconstituents present in NPK against spike receptor-binding domain (RBD) complexed with ACE2 protein (PDB ID: 6LZG) and RNA-dependent RNA polymerase protein (PDB ID: 7BTF) using...
Xie, Jiali Meng, Dan Li, Yihao Li, Ruoyu Deng, Ping
Published in
Molecular diversity
Discoidin domain receptor 1 (DDR1) (EC Number 2.7.10.1) has recently been considered as a promising therapeutic target for idiopathic pulmonary fibrosis (IPF). However, none of the currently discovered DDR1 inhibitors have been included in clinical studies due to low target specificity or druggability limitations, necessitating various approaches t...
Haghipour, Sirous Mehrdad, Morteza Hosseini, Samanesadat Moazzam, Ali Rad-Moghadam, Kourosh Mahdavi, Mohammad
Published in
Molecular diversity
This paper describes the development of 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylate compound as a heterocyclic enols containing a Michael acceptor so that it participates in an Ugi-type multicomponent condensation through a Smiles rearrangement in replacement of acid components. The new four-component containing 4-hydroxy-2-oxo-1,2-dihydroqu...
