Cheminformatic Tools and Databases for Pharmacology

session 48455 - 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
OZANIMOD (has an active metabolite)

OZANIMOD


ATC L04AE02

IMMUNOSUPPRESSANTS
IMMUNOMODULATING
SPHINGOSINE 1- PHOSPHATE RECEPTOR (SIP) MODULATOR
TREATMENT OF RELAPSING FORMS OF MULTIPLE SCLEROSIS (MS)

ORAL

Cmax 0.6 NANOMOLAR

Tmax 7 HOUR

VD 5590 LITER

PPB 98.2 PERCENT

Cl 192 LITER / HOUR

HT 21 HOUR

SOLUBILITY FREELY SOLUBLE IN WATER

SPHINGOSINE 1- PHOSPHATE RECEPTORS S1P 1 AND 5

PDB 7EW0 (CRYO-EM STRUCTURE OF OZANIMOD -BOUND SPHINGOSINE-1-PHOSPHATE RECEPTOR 1 IN COMPLEX WITH GI PROTEIN)

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

Download experimental 3D coordinates of JEU with added hydrogens

Sphingosine 1-phosphate receptor 1 UNIPROT P21453 S1PR1 -- Sphingosine 1-phosphate receptor 5 UNIPROT Q9H228 S1PR5

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 |