Cheminformatic Tools and Databases for Pharmacology

session 21728 - Total of 1 hits - Display   hits per page:

Add another drug(s) by one keyword:
Exemple: “nib“ and click on the Search button (do not press Enter on the keyboard)

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
ALISKIREN

ALISKIREN


ATC C09XA02
ATC C09XA53
ATC C09XA52
ATC C09XA54
ATC C09DX02

CARDIOVASCULAR
ANTIHYPERTENSIVE
LOWER BLOOD PRESSURE
RENIN INHIBITOR

ORAL

Tmax 2 HOUR

F 2.5 PERCENT

VD 135 LITER

PPB 49 PERCENT

Cl 9 LITER / HOUR

HT 24 HOUR

SOLUBILITY HIGHLY SOLUBLE IN WATER

RENIN

PDB 2V0Z (CRYSTAL STRUCTURE OF RENIN WITH INHIBITOR 10 (ALISKIREN))

LIGAND CODE = C41 (link to the list of PDB complexes)

Download experimental 3D coordinates of C41 with added hydrogens

Renin UNIPROT P00797 REN

more at DrugCentral

EMA

ANSM (in French)

Inxight Drugs
Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



Copyright © 2019 Université Côte d'Azur CNRS - All rights reserved
  | Contact |