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Drug-induced Liver Injury (DILI) Compound Library

Catalog No. L5510
  Library Compound List   Excel SDF

Adverse drug events such as cardiotoxicity, hepatotoxicity and other organ toxicities, keep surfacing in the clinic and idiosyncratic drug toxicity continues to haunt the drug development process. Drug-induced liver injury (DILI) is common and nearly all classes of medications can cause liver disease. Although cardiotoxicity remains one of the main reasons for drug development termination, both during pre-clinical and clinical stages, DILI is the most common reason cited for withdrawal of an approved drug. The reason for this most likely lies in the fact that significant advancement in understanding the mechanistic basis of cardiotoxicity but the imperfect prediction of DILI risk.

DILI is thought to occur via several different mechanisms. Among these are direct impairment of the structural and functional integrity of the liver (e.g., mitochondrial dysfunction); production of a metabolite that alters hepatocellular structure and function; production of a reactive drug metabolite that binds to hepatic proteins to produce new antigenic drug-protein adducts, which are targeted by hosts’ defenses (the hapten hypothesis); and initiation of a systemic hypersensitivity response (i.e., drug allergy) that damages the liver.

TargetMol’s Drug-induced Liver Injury Compound Library collects 1040 hepatotoxicity causing compounds, including anti-cancer drugs, antibiotics, antituberculosis agents, antiretrovirals, antiepileptic agents, and cardiac medications, etc. It is not only a powerful tool for DILI research and other drug toxicities but is of crucial value in understanding the mechanisms of DILI, identifying biomarkers for early DILI prediction, and allowing timely recognition during drug development, thus finally achieving successful DILI prevention and assessment in the pre-marketing phase.

All products from TargetMol are for Research Use Only. Not for Human or Veterinary or Therapeutic Use.
Compound Libraries | TargetMol
Pack Size
1 mg
30 μL * 10 mM (in DMSO)
50 μL * 10 mM (in DMSO)
100 μL * 10 mM (in DMSO)
250 μL * 10 mM (in DMSO)
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Product Description

  • A unique collection of 1040 hepatotoxicity causing compounds, a powerful tool for drug toxicity study, can be used for HTS and HCS screening;
  • Include anti-cancer drugs, antibiotics, antituberculotic agents, antiretrovirals, antiepileptic agents, and cardiac medications, etc.;
  • Diversified in toxicities: Steatosis, Mitochondrial toxicity, cholestasis, drug allergy (hypersensitivity), etc.;
  • NMR and HPLC validated to ensure high purity and quality.

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Packaging And Storage

  • Powder or pre-dissolved DMSO solutions in 96/384 well plate with optional 2D barcode
  • Shipped with blue ice
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Library Composition

Antibacterial (257)
Autophagy (199)
Antibiotic (181)
Apoptosis (151)
Endogenous Metabolite (54)
5-HT Receptor (54)
Adrenergic Receptor (52)
DNA/RNA Synthesis (50)
Dopamine Receptor (45)
AChR (44)
COX (43)
Parasite (42)
HIV Protease (42)
Histamine Receptor (36)
Potassium Channel (30)
Topoisomerase (26)
Sodium Channel (26)
Ferroptosis (25)
Antifungal (24)
P450 (24)
Mitophagy (23)
Nucleoside Antimetabolite/Analog (22)
Calcium Channel (21)
Microtubule Associated (20)
RAAS (19)
VEGFR (19)
SARS-CoV (18)
PDGFR (18)
DNA Alkylator/Crosslinker (17)
Serotonin Transporter (17)
Reactive Oxygen Species (17)
Reverse Transcriptase (17)
GABA Receptor (16)
c-Kit (16)
Dehydrogenase (16)
Influenza Virus (16)
Estrogen/progestogen Receptor (15)
HDAC (14)
Norepinephrine (13)
PDE (13)
FLT (11)
ribosome (11)
EGFR (11)
PPAR (11)
HSV (11)
ROS (11)
NF-κB (10)
MRP (10)
MAO (10)
Antifolate (9)
Virus Protease (9)
HCV Protease (9)
TNF (8)
Bcr-Abl (8)
Raf (8)
Proteasome (8)
Antifection (8)
HMG-CoA Reductase (8)
Estrogen Receptor/ERR (8)
Androgen Receptor (8)
ALK (8)
Opioid Receptor (8)
FGFR (8)
Src (8)
DNA Alkylation (8)
HBV (7)
Retinoid Receptor (7)
NMDAR (7)
PI3K (7)
CDK (7)
Tyrosine Kinases (7)
Progesterone Receptor (6)
CaMK (6)
PKC (6)
MMP (6)
mTOR (6)
Phosphatase (6)
P-gp (6)
Carbonic Anhydrase (6)
c-RET (6)
Proton pump (6)
Adenosine Receptor (6)
Glucocorticoid Receptor (6)
DHFR (5)
ATPase (5)
iGluR (5)
Trk receptor (5)
GluR (5)
Thrombin (5)
Lipoxygenase (5)
Nrf2 (5)
DNA Methyltransferase (5)
MEK (5)
TLR (5)
Antiviral (5)
PARP (4)
AMPK (4)
ABC (4)
P2Y Receptor (4)
Phospholipase (4)
TAM Receptor (4)
AChE (4)
Monoamine Oxidase (4)
c-Met/HGFR (4)
ROS Kinase (4)
Antioxidant (4)
Chloride channel (4)
Glutathione Peroxidase (4)
Reductase (4)
Transferase (4)
TGF-beta/Smad (4)
Prostaglandin Receptor (4)
Fatty Acid Synthase (4)
BTK (4)
Xanthine Oxidase (3)
Melatonin Receptor (3)
HER (3)
STAT (3)
Factor Xa (3)
Gamma-secretase (3)
Monoamine Transporter (3)
Syk (3)
CAT (3)
AhR (3)
JAK (3)
Akt (3)
Endothelin Receptor (3)
Histone Methyltransferase (3)
Hedgehog/Smoothened (3)
Thyroid hormone receptor(THR) (3)
TRP/TRPV Channel (3)
DNA (3)
Hydroxylase (3)
DPP-4 (3)
Interleukin (3)
Rho (2)
RSV (2)
Pyroptosis (2)
Serine/threonin kinase (2)
UGT (2)
S1P Receptor (2)
OAT (2)
Sigma receptor (2)
Telomerase (2)
Smo (2)
NO Synthase (2)
IL Receptor (2)
NADPH (2)
DNA gyrase (2)
HSP (2)
HIF/HIF Prolyl-Hydroxylase (2)
GST (2)
GNRH Receptor (2)
FAK (2)
Drug Metabolite (2)
CRISPR/Cas9 (2)
Isocitrate Dehydrogenase (IDH) (2)
CFTR (2)
c-Fms (2)
CCR (2)
Beta Amyloid (2)
BCL (2)
Aminopeptidase (2)
Adenosine deaminase (2)
IGF-1R (2)
YAP (2)
LPL Receptor (2)
Mitochondrial Metabolism (2)
MT Receptor (2)
Leukotriene Receptor (2)
cholecystokinin (1)
CETP (1)
MAPK (1)
NPC1L1 (1)
Chk (1)
PAK (1)
NOD-like Receptor (NLR) (1)
MALT (1)
CSF-1R (1)
Sirtuin (1)
Cysteine Protease (1)
Decarboxylase (1)
LTR (1)
Somatostatin (1)
Caspase (1)
CaSR (1)
Beta-Secretase (1)
Mdm2 (1)
Aurora Kinase (1)
Aryl Hydrocarbon Receptor (1)
Aromatase (1)
Tyrosinase (1)
Anti-infection (1)
Annexin A (1)
Vasopressin Receptor (1)
VDA (1)
Neurokinin receptor (1)
Wnt/beta-catenin (1)
ACK (1)
Serine Protease (1)
Ephrin Receptor (1)
DUB (1)
Protease-activated Receptor (1)
Integrin (1)
Integrase (1)
IκB/IKK (1)
IAP (1)
Hydrogenase (1)
p38 MAPK (1)
PKA (1)
Histone Demethylase (1)
Platelet aggregation (1)
PLK (1)
Histone Acetyltransferase (1)
JNK (1)
Hexokinase (1)
Hck (1)
Guanylate cyclase (1)
IRE1 (1)
FXR (1)
Epigenetic Reader Domain (1)
ERK (1)
ROR (1)
ROCK (1)
Lipid (1)
Free radical scavengers (1)
Glucosidase (1)
Oxytocin Receptor (1)
NADPH-oxidase (1)
Ras (1)
RANKL/RANK (1)
GPR (1)
GRK (1)
GSK-3 (1)
GlyT (1)

Library Information Sample

Empty 1000025-07-9 1000413-72-8 229005-80-5 1000787-75-6 946387-07-1 1000998-59-3 1175526-27-8 1001288-58-9 1001350-96-4 1001404-83-6 Empty
Vadadustat TAK875 TAK-779 Tegobuvir RN-1734 BMS-687453 AM211 FT011 BMS754807 AAI101
Empty 1001625-82-6 1001645-58-4 1001753-24-7 1001908-89-9 1002304-34-8 1002-84-2 100291-86-9 100299-08-9 10030-52-1 10040-45-6 Empty
RPW-24 SRT1720 hydrochloride INH6 SRT 2183 AMG208 Pentadecanoic acid Apiopaeonoside Pemirolast potassium L-Anserine nitrate salt Sodium Picosulfate
Empty 100427-26-7 1004316-88-4 10045-45-1 100462-37-1 1004990-28-6 100-51-6 1005-24-9 1005264-47-0 1005334-57-5 1005342-46-0 Empty
Lercanidipine Cobicistat 1-Ethyl-2-benzimidazolinone ROSIRIDIN PF-AKT400 Benzyl alcohol 1-Methylnicotinamide chloride MX69 CVT-10216 LCL161
Empty 1005491-05-3 100-55-0 1005504-62-0 1005883-72-6 100643-71-8 1007207-67-1 10075-50-0 1007647-73-5 100784-20-1 10083-24-6 Empty
Tirasemtiv Roniacol Rg3039 Z433927330 Desloratadine CH5132799 5-Bromoindole Smurf1-IN-A01 Halosulfuron-methyl Piceatannol
Empty 100872-83-1 100874-08-6 1009119-64-5 1009119-65-6 100929-71-3 1009298-09-2 1009298-59-2 100929-99-5 1009734-33-1 10097-84-4 Empty
ML346 SB 4 Daclatasvir Daclatasvir dihydrochloride NADPH (tetracyclohexanamine) AZD8055 Vistusertib PAβN dihydrochloride HZ1157 Rotundine
Empty 1009816-48-1 1009817-63-3 1009820-21-6 100986-85-4 101001-34-7 1010411-21-8 1010-60-2 1011244-68-0 1011301-27-1 1011529-10-4 Empty
Thiamet G B-AP15 Silmitasertib Levofloxacin Pamicogrel GSK369796 Dihydrochloride 2-Chloronaphthoquinone TFAP Tenovin3 Azvudine
Empty 101152-94-7 101155-02-6 1011557-82-6 1011-74-1 101-20-2 1012054-59-9 101-21-3 101-26-8 101303-98-4 1013101-36-4 Empty
Milnacipran hydrochloride BW-A78U Tenovin-6 DL-Normetanephrine hydrochloride Triclocarban CUDC101 Chlorpropham Mestinon Zacopride hydrochloride PF04691502
Empty 101-31-5 1013-69-0 1013750-77-0 1013753-99-5 10138-52-0 1013920-15-4 1013937-63-7 1014691-61-2 101477-54-7 101494-95-5 Empty
L-Hyoscyamine Noreugenin ML-030 BC-1382 Gadolinium chloride Vorolanib VTP-27999 TFA GSK0660 Lomerizine hydrochloride 8-CHLOROQUINAZOLIN-4(1H)-ONE
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