Cheminformatic Tools and Databases for Pharmacology

session 85060 - 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
HYDROCHLOROTHIAZIDE

HYDROCHLOROTHIAZIDE


ATC C09XA52
ATC C09XA54
ATC C09DX06
ATC C03AA03
ATC C03AB03
ATC C03EA01
ATC C03AX01
ATC C09DX07
ATC C09DX03
ATC C09BX03
ATC C09DX08
ATC C09DX01

CARDIOVASCULAR
ANTIHYPERTENSIVE AGENTS
DIURETICS
MAY INVOLVE CARBONIC ANHYDRASE INHIBITION (PMID24352504)

ORAL

Cmax 454.2 NANOMOLAR

Tmax 1.5 HOUR

VD 370.5 LITER (65 KILOGRAM)

PPB 67.9 PERCENT

Cl 23 LITER / HOUR

HT 4.5 HOUR

SOLUBILITY SLIGHTLY SOLUBLE IN WATER

CARBONIC ANHYDRASE

PDB 3IJX (CRYSTAL STRUCTURE OF THE AMPA SUBUNIT GLUR2 BOUND TO THE ALLOSTERIC MODULATOR, HYDROCHLOROTHIAZIDE)

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

Download experimental 3D coordinates of HCZ with added hydrogens

Solute carrier family 12 member 3 UNIPROT P55017 SLC12A3

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 |