|
Empagliflozin
|
|
Drug
Multitarget
Sodium-glucose cotransporter 2
Glycoside
|
|
|
Canagliflozin
|
|
Drug
Multitarget
Sodium-glucose cotransporter 2
Thiophen
Sulfur Compound
Glycoside
|
|
|
SCHEMBL31034887
|
BCHE
|
Imidazole
Carboxamide
Adrenergic-Receptor-ligand
Pro-Drug
|
|
|
Terazosin
|
Monoglyceridelipase_lysophospholip
|
Not AlphaBeta Hydrolase target
Drug
Quinazoline
Piperazine
Sulfur Compound
|
|
|
Voclosporin
|
ACHE
|
Drug
Peptide
|
|
|
Bromhexine
|
|
Natural
Drug
|
|
|
Acetaminophen
|
Lipase_3
|
Not AlphaBeta Hydrolase target
Drug
Multitarget
|
|
|
Ticagrelor
|
Pancreatic_lipase
|
Not AlphaBeta Hydrolase target
Drug
Pyrimidine
Triazol
Sulfur Compound
Antiplatelet
Cyclopropyl
|
|
|
Neo-212
|
|
Carbamate
Imidazole
Natural_modified
Terpenoid
Azabicyclo
Drug
Pro-Drug
|
|
|
Duloxetine
|
BCHE
|
Drug
Multitarget
Sodium:neurotransmitter symporter
Naphthalen
Sulfur Compound
Thiophen
|
|
|
Periciazine
|
BCHE
|
Not AlphaBeta Hydrolase target
Phenothiazine
Multitarget
Drug
Sulfur Compound
Piperidine
Cyanide
|
|
|
Retagliptin
|
DPP4N_Peptidase_S9
|
Drug
Gliptin
Triazol
Trifluoro
Pro-Drug
Imidazole
|
|
|
Itopride
|
ACHE
|
Not AlphaBeta Hydrolase target
Drug
Carboxamide
Dopamine antagonist
Benzamide
|
|
|
Meropenem
|
ACPH_Peptidase_S9
|
Antibiotic
Pyrrolidine
Carboxamide
Drug
Sulfur Compound
Azabicyclo
|
|
|
Sofosbuvir
|
Carb_B_Chordata
|
Pro-Drug
Drug
Propionate
Not AlphaBeta Hydrolase target
|
|
|
Loperamide
|
Carb_B_Chordata
|
Piperidine
Drug
Not AlphaBeta Hydrolase target
Opioid analgesic
|
|
|
Imidocarb
|
ACHE
|
Urea derivative
Drug
|
|
|
Valsartan
|
Pectinacetylesterase-Notum
|
Not AlphaBeta Hydrolase target
Drug
Tetrazol
Biphenyl
|
|
|
Felbinac
|
Pectinacetylesterase-Notum
|
Fragment inhibitor of Notum
Drug
Biphenyl
Not AlphaBeta Hydrolase target
|
|
|
Cotinine
|
Pectinacetylesterase-Notum
|
Derivative of Nicotine
Pyrrolidine
Natural
Alkaloid
Drug
Nicotinic agonist
Not AlphaBeta Hydrolase target
|
|
|
Riluzole
|
Pectinacetylesterase-Notum
|
Drug
Benzothiazol
Trifluoro
Sulfur Compound
Not AlphaBeta Hydrolase target
Fragment inhibitor of Notum
Thiazole
|
|
|
Bepridil
|
Pectinacetylesterase-Notum
|
Pyrrolidine
Not AlphaBeta Hydrolase target
Drug
Calcium Channel Antagonist
|
|
|
Emetine
|
Hydrolase_RBBP9_YdeN
|
Natural
Alkaloid
Drug
Isoquinoline
Quinoline
Quinolizine
|
|
|
Fenoverine
|
BCHE
|
Not AlphaBeta Hydrolase target
Drug
Phenothiazine
Sulfur Compound
Piperazine
Benzodioxo
|
|
|
Remdesivir
|
Carb_B_Chordata
|
Pro-Drug
Drug
Not AlphaBeta Hydrolase target
Propionate
Triazine
Cyanide
|
|
|
Idalopirdine-rivastigmine
|
BCHE
|
Drug
Pro-Drug
Carbamate
Derivative of Rivastigmine
Multitarget
5-HT-receptor-ligand
|
|
|
CHEMBL1784957
|
ACHE
|
Drug
Pro-Drug
Carbamate
Derivative of Rivastigmine
|
|
|
Tilorone
|
ACHE
|
Drug
Fluoren
|
|
|
Caffeine
|
Pectinacetylesterase-Notum
Lipase_3
|
Purine
Alkaloid
Natural
Drug
Not AlphaBeta Hydrolase target
|
|
|
Amodiaquine
|
ACHE
|
Quinoline
Not AlphaBeta Hydrolase target
Drug
|
|
|
Sucrose-octasulfate
|
Pectinacetylesterase-Notum
|
Sulfur Compound
Glycoside
Not AlphaBeta Hydrolase target
Drug
|
|
|
Anagliptin
|
DPP4N_Peptidase_S9
|
Drug
Cyanide
Pyrrolidine
Gliptin
Pyrimidine
Carboxamide
Pyrazole
|
|
|
Eprotirome
|
CFTR-inhibitory-factor_Cif
|
Thyroid hormone analogue
Drug
Urea derivative
|
|
|
Tiratricol
|
CFTR-inhibitory-factor_Cif
|
Natural
Drug
Thyroid hormone analogue
|
|
|
Fulvestrant
|
Epoxide_hydrolase
|
Trifluoro
Sulfur Compound
Drug
Not AlphaBeta Hydrolase target
Phenanthrene
|
|
|
Carmegliptin
|
DPP4N_Peptidase_S9
|
Drug
Pyrrolidine
Gliptin
Quinolizine
|
|
|
Dutogliptin
|
DPP4N_Peptidase_S9
|
Drug
Pyrrolidine
Gliptin
Boron compound
|
|
|
Gemigliptin
|
DPP4N_Peptidase_S9
|
Drug
Piperidine
Pyrimidine
Gliptin
Trifluoro
Delta-lactam
|
|
|
Gosogliptin
|
DPP4N_Peptidase_S9
|
Drug
Piperidine
Pyrimidine
Gliptin
|
|
|
Trelagliptin
|
DPP4N_Peptidase_S9
|
Drug
Piperidine
Pyrimidine
Cyanide
Gliptin
|
|
|
Teneligliptin
|
DPP4N_Peptidase_S9
|
Drug
Piperazine
Pyrrolidine
Gliptin
Thiazolidine
Sulfur Compound
Pyrazole
|
|
|
Valpromide
|
Epoxide_hydrolase
|
Drug
Carboxamide
|
|
|
EC5026
|
Epoxide_hydrolase
|
Urea derivative
Trifluoro
Piperidine
Drug
|
|
|
GSK2256294A
|
Epoxide_hydrolase
|
Urea derivative
Cyanide
Carboxamide
Triazine
Drug
|
|
|
Ar9281
|
Epoxide_hydrolase
|
Adamantyl
Urea derivative
Drug
|
|
|
Methylene-blue
|
ACHE
BCHE
|
Dye
Drug
Phenothiazine
anti-tau-aggregation
Multitarget
Sulfur Compound
Antioxidant
|
|
|
Evogliptin
|
DPP4N_Peptidase_S9
|
Drug
Gliptin
Trifluoro
|
|
|
Saxagliptin
|
DPP4N_Peptidase_S9
|
Adamantyl
Drug
Cyanide
Pyrrolidine
Gliptin
Azabicyclo
|
|
|
Linagliptin
|
DPP4N_Peptidase_S9
|
Drug
Purine
Gliptin
Quinazoline
Alkyne
|
|
|
Vildagliptin
|
DPP4N_Peptidase_S9
|
Drug
Pyrrolidine
Gliptin
Adamantyl
Cyanide
|
|
|
Alogliptin
|
DPP4N_Peptidase_S9
|
Drug
Piperidine
Pyrimidine
Cyanide
Gliptin
|
|
|
Sitagliptin
|
DPP4N_Peptidase_S9
|
Drug
Piperidine
Gliptin
Triazol
Trifluoro
|
|
|
Demecarium
|
ACHE
BCHE
|
Trimethylammonium
Ammonium
Bisquaternary
Drug
|
|
|
Mylaxen
|
BCHE
|
Neuromuscular Nondepolarizing Agents
Drug
Fluoren
Ammonium
Bisquaternary
|
|
|
Ladostigil
|
ACHE
BCHE
|
Monoamine-oxidase-inhibitor
Multitarget
Carbamate
Drug
Inden
|
|
|
Acotiamide
|
ACHE
|
Drug
Sulfur Compound
Carboxamide
|
|
|
Ambenonium
|
BCHE
|
Bisquaternary
Drug
|
|
|
Pyridophen-10
|
ACHE
|
Muscarinic antagonist
Propionate
Carbamate
Pro-Drug
Multitarget
Not AlphaBeta Hydrolase target
PET probe
|
|
|
Dimethylhydroxycarbaphen
|
BCHE
|
Muscarinic antagonist
Propionate
Carbamate
Pro-Drug
Multitarget
Not AlphaBeta Hydrolase target
|
|
|
Aricept~Donepezil~E2020
|
ACHE
|
Derivative of Donepezil
Piperidine
Drug
Inden
|
|
|
Atracurium
|
BCHE
|
Not AlphaBeta Hydrolase target
Neuromuscular Nondepolarizing Agents
Drug
Isoquinoline
Propionate
Dimethoxyphenyl
|
|
|
Atropine
|
ACHE
|
Not AlphaBeta Hydrolase target
Muscarinic antagonist
Drug
Alkaloid
Natural
Azabicyclo
Propionate
|
|
|
Terbutaline-monocarbamate
|
BCHE
|
Derivative of Bambuterol
Carbamate
Drug
tert-Butyl
Not AlphaBeta Hydrolase target
Pro-Drug
|
|
|
Bambuterol
|
BCHE
|
Derivative of Bambuterol
Carbamate
Drug
tert-Butyl
Not AlphaBeta Hydrolase target
Pro-Drug
|
|
|
Carbachol
|
ACHE
BCHE
|
Not AlphaBeta Hydrolase target
Carbamate
Trimethylammonium
Ammonium
Analogue of substrate
Drug
Muscarinic agonist
Nicotinic agonist
|
|
|
Chlorpromazine
|
ACHE
BCHE
|
Not AlphaBeta Hydrolase target
Phenothiazine
Multitarget
Drug
Sulfur Compound
|
|
|
Cocaine
|
BCHE
|
Natural
Not AlphaBeta Hydrolase target
Drug
Alkaloid
Benzoate
|
|
|
D-tubocurarine
|
ACHE
|
Natural
Alkaloid
Neuromuscular Nondepolarizing Agents
Not AlphaBeta Hydrolase target
Drug
|
|
|
Decamethonium
|
BCHE
|
Bisquaternary
Trimethylammonium
Ammonium
Neuromuscular Nondepolarizing Agents
Nicotinic antagonist
Drug
Not AlphaBeta Hydrolase target
|
|
|
Dibucaine
|
BCHE
|
Local anesthetic
Quinoline
Drug
Not AlphaBeta Hydrolase target
Carboxamide
|
|
|
Echothiophate
|
BCHE
|
Drug
Organophosphate
Sulfur Compound
Organothiophosphate
Trimethylammonium
Ammonium
|
|
|
Edrophonium
|
ACHE
BCHE
|
Drug
Quaternary compound
Trimethylammonium
Ammonium
|
|
|
Rivastigmine
|
ACHE
|
Derivative of Rivastigmine
Carbamate
Drug
|
|
|
Ethopropazine
|
BCHE
ACHE
|
Phenothiazine
Drug
Sulfur Compound
|
|
|
Galanthamine
|
ACHE
|
Derivative of Galanthamine
Natural
Alkaloid
Drug
Benzazepin
Azepane
Multitarget
Nicotinic agonist
|
|
|
Tyramine
|
BCHE
|
Adrenergic Uptake Inhibitors
Not AlphaBeta Hydrolase target
Drug
|
|
|
Imipramine
|
BCHE
|
Adrenergic Uptake Inhibitors
Not AlphaBeta Hydrolase target
Drug
Azepane
Benzazepin
|
|
|
SN-38
|
Carb_B_Bacteria
Carb_B_Chordata
|
Drug
Derivative of Irinotecan
Not AlphaBeta Hydrolase target
Pro-Drug
|
|
|
Irinotecan
|
Carboxylesterase
Carb_B_Chordata
Carb_B_Bacteria
|
Carbamate
Drug
Derivative of Irinotecan
Not AlphaBeta Hydrolase target
|
|
|
Meperidine
|
BCHE
Carboxylesterase
Carb_B_Chordata
|
Piperidine
Drug
Not AlphaBeta Hydrolase target
Opioid analgesic
|
|
|
Methylprednisolone
|
BCHE
|
Drug
Steroid
Phenanthrene
Not AlphaBeta Hydrolase target
|
|
|
Methylprednisolone-acetate
|
BCHE
|
Steroid
Drug
Acetate
Phenanthrene
|
|
|
Metoclopramide
|
BCHE
|
Benzamide
Dopamine antagonist
Drug
Not AlphaBeta Hydrolase target
|
|
|
Mivacurium
|
BCHE
|
Neuromuscular Nondepolarizing Agents
Isoquinoline
Bisquaternary
Drug
Not AlphaBeta Hydrolase target
|
|
|
Nicotine
|
ACHE
BCHE
Pectinacetylesterase-Notum
|
Derivative of Nicotine
Pyrrolidine
Nicotinic agonist
Natural
Alkaloid
Drug
Not AlphaBeta Hydrolase target
|
|
|
Toluidine-Blue
|
ACHE
BCHE
|
Dye
Drug
Phenothiazine
Sulfur Compound
|
|
|
Phenothiazine
|
ACHE
|
Phenothiazine
Not AlphaBeta Hydrolase target
Multitarget
Drug
Sulfur Compound
|
|
|
Posiphen
|
ACHE
|
Derivative of physostigmine-eserine
Carbamate
Drug
Indole
|
|
|
Phenserine
|
ACHE
|
Derivative of physostigmine-eserine
Carbamate
Drug
Indole
|
|
|
Physostigmine~Eserine
|
ACHE
BCHE
Arylacetamide_deacetylase
|
Derivative of physostigmine-eserine
Natural
Carbamate
Drug
Indole
|
|
|
Procaine
|
BCHE
|
Local anesthetic
Drug
Not AlphaBeta Hydrolase target
|
|
|
Promazine
|
ACHE
BCHE
|
Phenothiazine
Drug
Sulfur Compound
Not AlphaBeta Hydrolase target
|
|
|
Promethazine
|
ACHE
BCHE
|
Phenothiazine
Drug
Not AlphaBeta Hydrolase target
Muscarinic antagonist
Sulfur Compound
|
|
|
Distigmine
|
BCHE
|
Carbamate
Drug
Pyridine
|
|
|
Pyridostigmine
|
BCHE
ACHE
|
Carbamate
Drug
Pyridine
|
|
|
Tetracaine
|
BCHE
|
Local anesthetic
Drug
Not AlphaBeta Hydrolase target
|
|
|
Vecuronium
|
BCHE
|
Neuromuscular Nondepolarizing Agents
Nicotinic antagonist
Aminosteroid
Piperidine
Drug
Acetate
Not AlphaBeta Hydrolase target
Phenanthrene
|
|
|
Tamoxifen
|
Carboxylesterase
Carb_B_Chordata
|
Drug
Natural
Not AlphaBeta Hydrolase target
|
|
|
Mevastatin
|
Carboxylesterase
Carb_B_Chordata
|
Drug
Natural
Not AlphaBeta Hydrolase target
Naphthalen
Antibiotic
|
|
|
Terbutaline
|
|
Not AlphaBeta Hydrolase target
Drug
tert-Butyl
Derivative of Bambuterol
|
|
|
Rocuronium
|
|
Neuromuscular Nondepolarizing Agents
Aminosteroid
Drug
Not AlphaBeta Hydrolase target
Morpholine
Phenanthrene
|
|
|
Amiloride
|
ACHE
BCHE
|
Carboxamide
Drug
Pyridine
Not AlphaBeta Hydrolase target
|
|