Cheminformatic Tools and Databases for Pharmacology

session 25443 - 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
SELUMETINIB (has an active metabolite)

SELUMETINIB


ATC L01EE04

ANTINEOPLASTIC
TREATMENT OF PEDIATRIC NEUROFIBROMAS (PN)
MITOGEN-ACTIVATED PROTEIN KINASE KINASES 1 AND 2 INHIBITOR

ORAL

Cmax 1.74 MICROMOLAR

Tmax 1.25 HOUR

F 62 PERCENT

VD 171 LITER

PPB 98.4 PERCENT

Cl 8.8 LITER / HOUR

HT 6.2 HOUR

SOLUBILITY SLIGHTLY SOLUBLE AT PH > 3

MEK1
MEK2

PDB 4U7Z (MITOGEN-ACTIVATED PROTEIN KINASE KINASE (MEK1) BOUND TO G805)

LIGAND CODE = 3EW (link to the list of PDB complexes)

Download experimental 3D coordinates of 3EW with added hydrogens

Dual specificity mitogen-activated protein kinase kinase 1 INHIBITOR Q02750 (MP2K1_HUMAN)ANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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