AdmeKit

Parameter

LogD:

LogP:

Distribution

BBB:

PPB: %

Vd: L

Metabolism

CYP3A4_S:

CYP3A4_I:

CYP2D6_I:

Elimination

t1/2: hr

CL: L/hr

Hep_CL: L/min

Options

C-t curve

Simulate Concentration-time curve

Determine elimination rate constants

AUC

Area Under the Curve

-

AUMC

Area Under First moment Curve

MRT

Mean Residence Time (AUMC/AUC)

Options

Multiple dosing

Simulation of Multiple dosing

Steady State

Steady state parameters

Other values used

Interval: hr

Doses:

Options

Multiple dosing

Simulation of Multiple dosing

Steady State

Steady state parameters

Other values used

Interval: hr

Doses:

Other values used

Ke: 1/hr

Kt: 1/hr

-

Lag t1: hr

Lag t2: hr

Lag t3: hr

Euler's method

Simulation of First-Pass Effect with Euler's method

Single Dose Metabolism

First-Pass Effect for Single Dose Metabolism

Estimate k

Estimate Metbolism rate constant (k)

Hepatic Extraction

Estimate Hepatic Extraction

Multiple Dose Metabolism

First-Pass Effect for Multiple Dose Metabolism

Metabolism Rate

Metabolism Rate for Multiple Dose Metabolism

Interval: hr

Doses:

Model Simulation

Model Simulation with Elimination

Estimate ke (A)

Estimate elimination rate constant for A

Estimate ke (B)

Estimate elimination rate constant for B

Renal Clearance (A)

Estimate Renal Clearance for A

Renal Clearance (B)

Estimate Renal Clearance for B

Hepatic Clearance Model

Simulate Hepatic Clearance model

Hepatic Clearance Dynamics

Hepatic Clearance dynamics

Effect of fu

Effect of Fraction unbound in Plasma

Simulation

Population Single dose Simulation

AUC & t1/2

Area Under the Curve and Half life Distribution

fu variability

Effect of Protein Variability on Drug Levels

Individuals:

m_CL:

CL_v:

m_Vd:

Vd_v:

fu 1:

fu 2:

fu 3:

Simulation

Population Multiple Dose Simulation

fu Effect (By Gender)

Effect of Protein Variability on Drug Levels (By gender)

AUC (By Gender)

Area Uner the Curve Distribution (By gender)

Individuals:

ke: 1/hr

M_ke:

F_ke:

M_fu:

f_fu:

Dose_int: hr

Mean fu(Gen):

fu 1:

fu 2:

T_range: - mg

Options

Simulation

Simulation of Pharmacogenomic Effects of SLCO1B1 transporter

SLCO1B1 Effects on pk

Pharmacogenomic Effects of SLCO1B1 transporter on Pharmacokinetics

Variants Activities

*1a/*1a: ,

*1a/*1b: ,

*1b/*1b: ,

-

*1a/*15: ,

*1b/*15: ,

*15/*15: ,

Values used to Calculate Dose

Calculations

Parameter

Distribution

Metabolism

Elimination

Options

-

Options

Other values used

Options

Other values used

Other values used

-

Options

Other values used

Options

Other Values

Options

Variants Activities

-

Simulation