Cheminformatic Tools and Databases for Pharmacology

session 51175 - 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
TIMOLOL

TIMOLOL


ATC C07AA06
ATC S01ED01
ATC C07BA06
ATC S01ED51
ATC C07DA06

CARDIOVASCULAR
NON-SELECTIVE BETA ADRENERGIC BLOCKER
ANTI-ARRHYTHMIA AGENTS
ANTIHYPERTENSIVE AGENTS
ANTIMIGRAINE
ANTIGLAUCOMA
ANTIANGINAL

ORAL OPHTHALMIC

Cmax 1.45 NANOMOLAR

VD 97.5 LITER (65 KILOGRAM)

PPB 10 PERCENT

Cl 33.1 LITER / HOUR (65 KILOGRAM)

HT 2.2 HOUR

SOLUBILITY SOLUBLE IN WATER

BETA-1 ADRENERGIC RECEPTOR
BETA-2 ADRENERGIC RECEPTOR

PDB 3D4S (CHOLESTEROL BOUND FORM OF HUMAN BETA2 ADRENERGIC RECEPTOR.)

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

Download experimental 3D coordinates of TIM with added hydrogens

Beta-1 adrenergic receptor UNIPROT P08588 ADRB1 -- Beta-2 adrenergic receptor UNIPROT P07550 ADRB2

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 |