Table 5.

Consensus values calculated from the Score energies of the Citronelal derivatives under study and their Alzheimer’s and Parkinson’s disease target enzymes.

	Citronelal Derivatives
ID	Parkinson’s Disease Targets						Alzheimer’s Disease Targets
	α-Sinuclein	Adenosin A2A	COMT	MAO	D1	D2	AChE	BACE	GSK3	TACE
C1 -Methoxycitronellal	0.9041	0.7119	0.7225	0.6931	0.6570	0.5919	0.4480	0.7889	0.4990	0.5665
C2 D-Citronellal	0.8824	0.6529	0.7029	0.6355	0.6472	0.5489	0.4044	0.6583	0.5277	0.5218
C3 Hydroxycitronellal	0.8762	0.6645	0.7376	0.6686	0.6329	0.5547	0.4290	0.7201	0.3772	0.5325
C4 Citronelic Acid	0.9796	0.6630	0.8521	0.6891	0.6376	0.5781	0.4944	0.6009	0.5547	0.5273
C5 Isopulegol	0.7749	0.4468	0.6870	0.5416	0.5646	0.5566	0.2802	0.5456	0.4604	0.4965
C6 Menthol	0.7837	0.5039	0.7161	0.5785	0.5676	0.5358	0.3533	0.6146	0.4601	0.4850
C7 S-Citronellal	0.8883	0.6416	0.7251	0.6564	0.5926	0.5551	0.4154	0.6538	0.5053	0.5118
Positive Control	0.9718	0.5	0.8113	0.6163	0.6853	0.6586	0.6911	-	-	-
PDB Ligand	-	0.9386	1	0.5	0.8026	1	1	1	1	1

Note: The molecule with the highest probability is in bold. Compounds with a higher probability than the ligand are in yellow.