Cheminformatic Tools and Databases for Pharmacology

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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
KANAMYCIN DISCONTINUED

KANAMYCINNATURAL MOLECULE (link)


ATC A07AA08
ATC J01GB04
ATC S01AA24

ANTIINFECTIVES
ANTIBIOTIC
ANTIBACTERIAL
PROTEIN SYNTHESIS INHIBITORS

ORAL INJECTION

VD 16.9 LITER (65 KILOGRAM)

PPB 1 PERCENT

Cl 5.4 LITER / HOUR (65 KILOGRAM)

HT 2.1 HOUR

AMINOGLYCOSIDE 3'-PHOSPHOTRANSFERASE APHA1-IAB
KANAMYCIN NUCLEOTIDYLTRANSFERASE

PDB 4FEX (CRYSTAL STRUCTURE OF THE AMINOGLYCOSIDE PHOSPHOTRANSFERASE APH(3')-IA, WITH SUBSTRATE KANAMYCIN AND SMALL MOLECULE INHIBITOR TYRPHOSTIN AG1478)

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

Download experimental 3D coordinates of KAN with added hydrogens

Unknown

more at DrugCentral

EMA

ANSM (in French)

Inxight Drugs
Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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