Cheminformatic Tools and Databases for Pharmacology

session 38632 - Total of 3 hits - Display   hits per page:

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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
DIPIVEFRIN DISCONTINUED (has an active metabolite)

DIPIVEFRIN


ATC S01EA02

SENSORY
ADRENERGIC AGONISTS
SYMPATHOMIMETICS
CONTROL OF INTRAOCULAR PRESSURE IN CHRONIC OPEN-ANGLE GLAUCOMA

OPHTHALMIC

SOLUBILITY FREELY SOLUBLE IN WATER

ALPHA-2A ADRENERGIC RECEPTOR

ADRENERGIC RECEPTOR AGONIST CHEMBL2331074 ADRENERGIC RECEPTOR P07550 BETA-2 ADRENERGIC RECEPTOR HOMO SAPIENS MEMBRANE RECEPTOR 7TM1 SMALLMOL MONOAMINE RECEPTOR ADRENERGIC RECEPTORANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank

2 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
DIPIVEFRIN DISCONTINUED (has an active metabolite)

DIPIVEFRIN


ATC S01EA02

SENSORY
ADRENERGIC AGONISTS
SYMPATHOMIMETICS
CONTROL OF INTRAOCULAR PRESSURE IN CHRONIC OPEN-ANGLE GLAUCOMA

OPHTHALMIC

SOLUBILITY FREELY SOLUBLE IN WATER

ALPHA-2A ADRENERGIC RECEPTOR

ADRENERGIC RECEPTOR AGONIST CHEMBL2331074 ADRENERGIC RECEPTOR P07550 BETA-2 ADRENERGIC RECEPTOR HOMO SAPIENS MEMBRANE RECEPTOR 7TM1 SMALLMOL MONOAMINE RECEPTOR ADRENERGIC RECEPTORANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank

3 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
EPINEPHRINE (is an active metabolite)

EPINEPHRINENATURAL MOLECULE (link)


ATC A01AD01
ATC B02BC09
ATC C01CA24
ATC R01AA14
ATC R03AA01
ATC S01EA01
ATC R03AK01
ATC S01EA51

METABOLISM
ADRENERGIC AGONISTS
BRONCHODILATOR AGENTS
MYDRIATICS
SYMPATHOMIMETICS
VASOCONSTRICTOR AGENTS
EMERGENCY TREATMENT OF SEVERE ALLERGIC REACTIONS

INJECTION INHALATION INTRAMUSCULAR SUBCUTANEOUS IONTOPHORESIS TOPICAL INTRAVENOUS INTRAOCULAR

HT 0.05 HOUR

SOLUBILITY SOLUBLE IN WATER

ALPHA ADRENERGIC RECEPTOR
BETA ADRENERGIC RECEPTOR

PDB 4LDO (STRUCTURE OF BETA2 ADRENOCEPTOR BOUND TO ADRENALINE AND AN ENGINEERED NANOBODY)

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

Download experimental 3D coordinates of ALE with added hydrogens

ADRENERGIC RECEPTOR AGONIST CHEMBL2331074 ADRENERGIC RECEPTOR P07550 BETA-2 ADRENERGIC RECEPTOR HOMO SAPIENS MEMBRANE RECEPTOR 7TM1 SMALLMOL MONOAMINE RECEPTOR ADRENERGIC RECEPTORANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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