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Table 1 The predicted Km (Ki) and Vmax values in ADMET Predictor™ for gartanin and α-mangostin

From: In vitro investigation of metabolic fate of α-mangostin and gartanin via skin permeation by LC-MS/MS and in silico evaluation of the metabolites by ADMET predictor™

CYP Gartanin α-mangostin
Inhibition Substrate Km
(μM)
Vmax
(nmol/min/nmol P450)
CLint1)
mL/min/nmol P450)
Inhibition Substrate Km
(μM)
Vmax
(nmol/min/nmol P450)
CLint1)
mL/min/nmol P450
1A2 34.300 0.397 0.0115 6.740 0.171 0.0254
2C9 0.648 0.083 0.128 0.556 0.033 0.0594
2C19 90.200 0.013 0.00014 41.400 0.014 0.00039
2D6 29.700 109.000 3.67 23.600 103.000 4.364
1) CLint parameters were calculated using Vmax/Km.
CYP Gartanin α-mangostin
Inhibition Substrate Ki
(μM)
Inhibition Substrate Ki
(μM)
3A4_mid 19.951 21.913
3A4_tes 4.274 2.793
  1. mid midazolam; tes testosterone