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| Article Name : | | | DEVELOPMENT OF SMALL MOLECULAR INHIBITOR AGAINST BCR-ABL PROTEIN COMPLEX INVOLVED IN CHRONIC MYELOGENOUS LEUKEMIA THROUGH DOCKING STUDIES. | | Author Name : | | | TUSHAR SHINDE, AKHIL JOBBY | | Publisher : | | | Ashok Yakkaldevi | | Article Series No. : | | | ROR-540 | | Article : | |  | Author Profile | | Abstract : | | | Chronic Myelogenous Leukemia (CML) is caused due to the transformation of hematopoietic stem cells and the cardinal reason of abnormality of CML is (9;22)(q34;q11) translocation. This was primarily recognized as an abnormal chromosome and thereafter named as “Philadelphia Chromosome”. This translocation results in the Bcr-Abl fusion gene and activation of protein tyrosine kinase (PTK). Mainly, malignant transformation of Bcr-Abl is dependent on the protein tyrosine kinase (PTK) activity. Normally, c-Abl1 is involved in cellular processes and is rigorously controlled in order to prevent oncogenic activity but this activity of c-Abl1 protein is negatively regulated by its SH3 domain, and deletion of the SH3 domain results in transformation of Abl1 into an oncogene. Hence, the drug which we designed may inhibit activity of the protein tyrosine kinase, and has c-docker energy and carcinogenicity of -25.123, 0.000 respectively which can ultimately help in normal regulation of the protein. In this work, systematic target identification, ligand modeling and docking studies were performed, which were validated by previously presented research studies and the drug candidate we designed binds to Bcr-Abl Oligomeric protein domain at different regions and may eventually inhibit the activity of Protein tyrosine kinase (PTK). | | Keywords : | | - C-Docker
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