Identification of potential binding pocket on viral oncoprotein HPV16 E6: a promising anti-cancer target for small molecule drug discovery

Table 1 Docking scores of flavonols at potential BPs along with experimental K_i values

Ligand	BP# 23	BP# 24	BP# 25	BP# 26	BP# 27	BP# 28	Experimental K_i (μM)^a
myricetin	44.9843	43.4749	39.7426	34.9258	33.4030	31.5181	0.85
morin	41.5695	40.0641	38.2520	31.4341	25.6152	29.3939	4.0
quercetin	40.2787	38.7066	32.9974	32.1224	26.5935	30.9113	~ 40
6-hydroxy flavonol	41.3446	41.8128	31.3729	30.6833	23.4966	31.0623	~ 40
galangin	41.7086	32.1758	31.7116	31.5844	26.8369	26.5540	~ 40
kaempferol	38.3442	26.1726	34.3741	27.1258	24.6340	24.1499	> 40

ISSN: 2661-8850