Cheminformatic Tools and Databases for Pharmacology

session 13510 - 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
PHENYLBUTYRATE (is an active metabolite) (has an active metabolite)

PHENYLBUTYRATE


ATC A16AX03

METABOLISM
SUPPLEMENT
DECREASED ELEVATED PLASMA AMMONIA GLUTAMINE LEVELS
ANTIHYPERAMMONEMIC
UREA CYCLE DISORDERS
RAPIDLY METABOLIZED TO PHENYLACETATE
NITROGEN-BINDING AGENT FOR CHRONIC UREAC CYCLE DISORDERS (UCDS)

ORAL

Cmax 1.32 MILLIMOLAR (5 GRAMS)

Tmax 1 HOUR

PPB 89 PERCENT

HT 0.77 HOUR

SOLUBILITY SOLUBLE IN WATER

PHENYLACETYL-COA: L-GLUTAMINE-N-ACETYLTRANSFERASE

PDB 3TZ2 (CRYSTAL STRUCTURE OF BRANCHED-CHAIN ALPHA-KETOACID DEHYDROGENASE KINASE/PHENYLBUTYRATE COMPLEX)

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

Download experimental 3D coordinates of CLT with added hydrogens

GLUTAMINE CHELATING AGENT CHEMBL2366039 GLUTAMINE HOMO SAPIENSANSM (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 |