Cheminformatic Tools and Databases for Pharmacology

session 37151 - 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
INDOMETHACIN

INDOMETHACIN


ATC C01EB03
ATC M01AB01
ATC M02AA23
ATC S01BC01
ATC M01AB51
ATC S01CC02

MUSCULO-SKELETAL SYSTEM
ANALGESIC
ANTIPYRETIC
ANTIINFLAMMATORY
CARDIOVASCULAR AGENTS
CYCLOOXYGENASE INHIBITORS
NONSTEROIDAL ANTIINFLAMMATORY AGENTS (NSAIDS)

ORAL RECTAL INJECTION

Cmax 5.6 MICROMOLAR

Tmax 2 HOUR

F 100 PERCENT

VD 6.24 LITER (65 KILOGRAM)

PPB 99 PERCENT

Cl 5.07 LITER / HOUR (65 KILOGRAM)

HT 4.5 HOUR

SOLUBILITY PRACTICALLY INSOLUBLE IN WATER

PROSTAGLANDIN G/H SYNTHASE 1
PROSTAGLANDIN G/H SYNTHASE 2

PDB 4IKI (CRYSTAL STRUCTURE OF WILD-TYPE HUMAN TRANSTHYRETIN IN COMPLEX WITH INDOMETHACIN)

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

Download experimental 3D coordinates of IMN with added hydrogens

CYCLOOXYGENASE INHIBITOR CHEMBL2094253 CYCLOOXYGENASE P23219 PROSTAGLANDIN G/H SYNTHASE 1 HOMO SAPIENS ENZYME REDUCTASEANSM (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 |