Potency Evaluation of Temulawak Through Physicochemical, Pharmacokinetics, Druglikeness, Water Solubility, Tox Prediction for KUB Chickens
DOI:
https://doi.org/10.51601/ijse.v5i4.281Abstract
Temulawak is one of the spices in Indonesia that is useful as a phytobiotic. Phytobiotics are beneficial for livestock in maintaining health, namely maintaining immunity, especially in chickens. One type of chicken that is widely cultivated in Indonesia is the KUB chicken to increase its productivity. This study aims to identify the potential compounds found in temulawak (Curcuma Xanthorrhiza). The research methods included literature studies and ADMET testing. The most abundant compound in temulawak was β-Curcumene with a molecular weight of 204.35 g/ml, a hydrogen bond donor count of 0, a hydrogen bond acceptor count of 0, and a TPSA value of 0.00 Å2 . The β-Curcumene compound is not classified as an inhibitor of CYP1A2, CYP2C19, CYP2D6, CYP3A4. β-Curcumene has drug-like properties according to the rules of Lipinski, Ghose, Veber, Egan but does not have drug-like properties according to Muegge's rules. The log S ESOL value of -4.93 is in the moderate solubility category, the log S SILICOS – IT value of -3.55 is good solubility, and the log S Ali value of -6.27 is in the poor solubility category. β-Curcumene has toxic compounds that are active and affect BBB-barrier performance by 97%, ecotoxicity target by 64%, estrogen hormone performance by 75%, and drug metabolism performance by 65%.
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Alfaridza, A.N., Astuti, R.I & Mubarik, N.R. (2025). Interaksi Molekuler Senyawa Kuersetin dan Eugenol terhadap Protein Regulator Lintasan Penuaan SIR2, pada Khamir Saccharomyces cerevisiae Molecular Interaction of Quercetin and Eugenol Compounds towards Regulatory Protein of Aging Pathway SIR2, in Yeast Saccharomyces cerevisiae. Biota: Jurnal Ilmiah Ilmu – Ilmu Hayati, 10(1), 44-52. 10.24002/biota.v10i1.6819
Anastasya, G., Wensa, L., Permata, S., Amatulloh, A., Fath, Z.T.A & Zuhrotun, A. (2023). In Silico Study of Klabet Seed Compounds (Trigonella foenum-gracum L.) As Alpha Estrogen Inhibitors in Breast Cancer. Indonesian Journal of Biological Pharmacy, 3(3), 183-193
Bahi, R.R.R., Herowati, R & Harmastuti. (2020). Studi Biokemoinformatika Kandungan Kimia Daun Sambiloto (Andrographis paniculata (Burm.f.) Nees) sebagai Antihiperglikemia serta Prediksi Parameter Farmakokinetik dan Toksisitas. Jurnal Farmasi Indonesia, 17(2), 466-477.
Daina, A., Michielin, O and Zoete, V. (2017). SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules. Sci Rep. 7. https://doi.org/10.1038/srep42717
Dara, A.I & Husni, P. (2017) Artikel Tinjauan : Teknik Meningkatkan Kelarutan Obat. Farmaka, 15(4), 49-57. https://doi.org/10.24198/jf.v15i4.14684
Fadlan, A., Warsito, T and Sarmoko. (2022). Evaluasi Parameter Fisikokimia, Farmakokinetika dan Farmakodinamika Senyawa Fisetin Dalam Desain Obat. Akta Kimia Indonesia, 7(1), 1-13.
Ferdiansyah, R., Ardiansyah, S.A., Rachmaniar, R & Yuniar, I. (2021). Review : The Effect Of Cocrystal Formation Using Carboxylic Acid Coformer With Solvent Evaporation And Solvent Drop Grinding Methods On Bioavailability of Active Substances. Jurnal Ilmiah Farmako Bahari, 12(1), 28-38.
Hajal, A.A & Meslamani, A.Z.A. (2024). Overcoming Barriers To Machine Learning Applications In Toxicity Prediction. Expert Opinion On Drug Metabolism & Toxicology, 20(7), 549-553.
Hakiki, A., Andika and Rahmawati. (2024). Studi Molecular Docking dan Prediksi ADMET Senyawa Turunan Kurkumin Sebagai Inhibitor Kasein Kinase 2-α. Lumbung Farmasi : Jurnal Ilmu Kefarmasian, 5(2), 195-212. https://doi.org/10.31764/lf.v5i2.22563
Izzaturahmi,A.S.,Pauziah,A.S.U.,Virliana,A.,Sitinjak,G.M.L.,Ramadhiany,Z.Z.,Elaine,A.A.,Sitinjak,B.D.P.,Aulifa,D.L.(2023).In Silico Study of Licorice (Glycyrrhiza glabra L) on VEGFR-2 Receptors in Breast Cancer. Indonesian Journal of Biological Pharmacy,3(3),137-153
Jantan, I., Saputri, F. C., Qaisar, M. N and Buang, F. (2012). Correlation between Chemical Composition of Curcuma domestica and Curcuma xanthorrhiza and Their Antioxidant Effect on Human Low-Density Lipoprotein Oxidation. Evidence-based complementary and alternative medicine : eCAM, 2012, 438356. https://doi.org/10.1155/2012/438356
Junita R.E., Wati, N.E and Suhadi, M. (2024). Pengaruh Pemberian tepung Temulawak (Curcuma Xanthoriza). Wahana Peternakan, 8(1): 80-85. https://doi.org/10.37090/jwputb.v8i1.1446
Krihariyani, D., Sasongkowati, R and Haryanto, E. (2020). Studi In Silico Sifat Farmakokinetik, Toksisitas, Dan Aktivitas Imunomodulator Brazilein Kayu Secang Terhadap Enzim 3-Chymotrypsin-Like Cysteine Protease Coronavirus. Journal of Indonesian Medical Laboratory and Science, 1(1) : 76-90. https://doi.org/10.53699/joimedlabs.v1i1.14
Laudengi, S., Hasan, N., U, Sasmita., Ilham, F., Dako, S & Zainudin, S. (2025). Produktivitas Ayam Kampung Unggul Balitnak (KUB) Pada Periode Starter.In Prosiding Seminar Nasional Mini Riset Mahasiswa(pp.122-126)
Lipinski, C. A., Lombardo, F., Dominy, B. W and Feeney, P. J. (2001). Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings. Advanced drug delivery reviews, 46(1-3), 3–26. https://doi.org/10.1016/s0169-409x(00)00129-0
Maulida, M.Z., Ummahati, D & Muna, L.N. (2023). Analisis Sifat Fisikokimia, Farmakokinetik, Dan Toksisitas Senyawa Aktif Dalam Jahe Merah (Zingiber Officinale Var Rubrum Rhizoma), Journal of Pharmaceutical Care and Sciences, 4(1), 90-98. 10.33859/jpcs.v4i1
Nursanti, O., Aziz, A & Hadisoebroto, G. (2023). Prediksi Toksisitas dan Farmakokinetika untuk
mendapatkan Kandidat Obat Analgesik. Journal Of Non Communicable Diseases, 3(1), 34-46.
Praceka, M.S., Yunita, E.N., Semesta, C.D., Putri, R.N., Mikdar, N.N., Sitinjak, E.N., Setyawati, L.U & Muchtaridi, M. (2022). Molecular Docking and Toxicity From Temulawak Rhizome (Curcuma Xanthorrhiza Roxb.) Against COX-2, Indonesian Journal of Pharmaceutical Science and Technology, 1(1), 106-115
Prastowo, B.F., Dewi, R.K and Qomarudin, M. (2020). Pengaruh Pemberian Temulawak (Curcuma xanthorrzharoxb) Untuk Penambahan Bobot Badan Ayam Kampung Usia 3 Bulan Sampai 4 Bulan. International Journal Of Animal Science, 3(3), 72-75.
Purwanto, H., Zurina, R., Definiati, N and L. Malianti. (2023). Pengaruh Pemberian Tepung Temulawak (Curcuma Xanthorriza Roxb) Dalam Ransum Terhadap Kualitas Telur Ayam Ras Petelur. Jurnal Inspirasi Peternakan, 3(3), 115-126
Ritchie, T. J., Ertl, P and Lewis, R. (2011). The graphical representation of ADME-related molecule properties for medicinal chemists. Drug discovery today, 16(1-2), 65–72. https://doi.org/10.1016/j.drudis.2010.11.002
Septama, A. W., Tasfiyati, A.N., Kristiana, R and Jaisi, A. (2022). Chemical Profiles of Essential Oil From Javanese Turmeric (Curcuma Xanthorrhiza Roxb.), Evaluation Of Its Antibacterial And AntiBiofilm Activities Against Selected Clinical Isolates. South African Journal of Botany, 146, 728-734. https://doi.org/10.1016/j.sajb.2021.12.017
Sahara, E., Riansyah, A., Farisi, S.E., Sandi, S., Sari, M.L., Muhakka and Riswandi. (2025). Manfaat Ekstrak Temulawak (Curcuma xanthorrhiza Roxb) Terhadap Peforma dan Kualitas Karkas Ayam Broiler, In Prosiding SAINTROP (pp. 251-262). Bengkulu, Indonesia
Sardar, H. (2023). Drug like potential of Daidzein using SwissADME prediction: In silico Approaches. PHYTONutrients, 2. https://doi.org/10.62368/pn.vi.18
Shao, C., Shao, F., Huang, S., Sun, R & Zhang, T. (2024). An Evolved Transformer Model for ADME/Tox Prediction, Electronics, 13, 1-15. https://doi.org/10.3390/electronics13030624
Sinabariba, D.B., Sitorus, T.F & Lumbantoruan, M. (2024). Pengaruh Pemberian Tepung Temulawak (Curcuma Zanthorrhiza) Dalam Ransum Terhadap Performans Pada Ayam Joper Umur 8 Minggu. Jurnal Ilmiah Peternakan,5(1), 35-42. https://doi.org/10.36655/jip.v5i1.1884
Staneva, Y., Iliev, I., Georgieva, S and Merdjanova, A. (2024). In silico prediction of physicochemical properties and drug-likeness of omega-3 fatty acids. Sciendo. 35(2), 118-125
Syafrizayanti, S., Putri, A., Salim, M., Kusnanda, A.J. (2023). Simulasi Inhibisi Aktivitas Enzim α-Amilase dan α-Glukosidase oleh Senyawa Bioaktif Mikroalga Spirulina platensis. ALCHEMY Jurnal Penelitian Kimia, 19(2), 223-233. 10.20961/alchemy.19.2.73120.223-233
Tian, S., Wang, J., Li, Y., Li, D., Xu, L., & Hou, T. (2015). The application of in silico drug-likeness predictions in pharmaceutical research. Advanced drug delivery reviews, 86, 2–10. https://doi.org/10.1016/j.addr.2015.01.009
Yusuf, M.A., Novieta, I.D & Fitriani. (2023). Konsumsi dan Pertambahan Bobot Badan Itik Mojosari (Anas platyrhynchos domesticus) yang Diberi Fitobiotik. Tarjih Tropical Livestock Journal, 3(1), 9-16. 10.47030/trolija.v3i1.497.
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