Cheminformatic Tools and Databases for Pharmacology

session 93288 - 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
APIXABAN

APIXABAN


ATC B01AF02

BLOOD
ANTICOAGULANT
ACTIVE SITE INHIBITOR OF FXA

ORAL

Tmax 3.5 HOUR

F 50 PERCENT

VD 21 LITER

PPB 87 PERCENT

Cl 3.3 LITER / HOUR

HT 12 HOUR

SOLUBILITY AQUEOUS SOLUBILITY ACROSS THE PHYSIOLOGICAL PH RANGE IS 0.04 MILLIGRAM / MILLILITER

FACTOR XA

PDB 2P16 (FACTOR XA IN COMPLEX WITH THE INHIBITOR APIXABAN (BMS-562247) AKA 1-(4-METHOXYPHENYL)-7-OXO-6-(4-(2-OXO-1-PIPERIDINYL)PHENYL)-4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[3, 4-C]PYRIDINE-3-CARBOXAMIDE)

LIGAND CODE = GG2 (link to the list of PDB complexes)

Download experimental 3D coordinates of GG2 with added hydrogens

COAGULATION FACTOR X INHIBITOR CHEMBL244 COAGULATION FACTOR X P00742 COAGULATION FACTOR X HOMO SAPIENS ENZYME PROTEASE SERINE PAS S1AEMA

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 |