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1 INNClassRoute (list)PK parameters= Cmax; Tmax; F: bioavailability; t1/2: half-life; VD: volume of distribution; Cl: clearance; PPB: plasma protein binding;(EQN means that value was calculated using VD=(Cl*t1/2)/0.693)Primary Target and PDB code of Protein-Drug complexTargets from DrugCentral Links
URSODIOL

URSODIOLNATURAL MOLECULE (link)


ATC A05AA02

METABOLISM
STEROL
CHOLERETIC
CHOLAGOGUES
ANTICHOLELITHOGENIC
TREATMENT OF PRIMARY BILIARY CIRRHOSIS
NATURALLY OCCURRING HYDROPHILIC BILE ACID
IN THE LIVER, URSODIOL IS CONJUGATED WITH GLYCINE OR TAURINE THEN SECRETED INTO BILE

ORAL

PPB 70 PERCENT

SOLUBILITY PRACTICALLY INSOLUBLE IN WATER

HYDROXYSTEROID DEHYDROGENASE/BILE ACID BINDING PROTEIN (PMID22223860)

PDB 1IHI (CRYSTAL STRUCTURE OF HUMAN TYPE III 3-ALPHA-HYDROXYSTEROID DEHYDROGENASE/BILE ACID BINDING PROTEIN (AKR1C2) COMPLEXED WITH NADP+ AND URSODEOXYCHOLATE)

LIGAND CODE = IU5 (link to the list of PDB complexes)

Download experimental 3D coordinates of IU5 with added hydrogens

BILE ACID RECEPTOR FXR AGONIST CHEMBL2047 BILE ACID RECEPTOR FXR Q96RI1 BILE ACID RECEPTOR HOMO SAPIENS TRANSCRIPTION FACTOR NUCLEAR RECEPTOR NR1 NR1H NR1H4ANSM (in French)

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