Cheminformatic Tools and Databases for Pharmacology

session 24440 - 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
RIMANTADINE

RIMANTADINE


ATC J05AC02

ANTIINFECTIVES
ANTIVIRAL
ANTI INFLUENZA A
RESISTANCE OBSERVED
CHANNEL BLOCKER

ORAL

Cmax 510 NANOMOLAR

VD 219 LITER (EQN)

PPB 40 PERCENT

Cl 3.9 LITER / HOUR

HT 39 HOUR

SOLUBILITY SOLUBLE IN WATER (50 MILLIGRAM / MILLILITER)

PROTON TRANSPORTER M2 (PMID23480101)

PDB 2BOC (INFLUENZA A M2 TRANSMEMBRANE DOMAIN BOUND TO RIMANTADINE IN THE INWARD(OPEN) CONFORMATION)

LIGAND CODE = EU7 (link to the list of PDB complexes)

Download experimental 3D coordinates of EU7 with added hydrogens

Matrix protein 2 UNIPROT P63231 M

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 |