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Anti-COVID-19 Compound Library

Catalog No. L1710
  Library Compound List   Excel SDF

In response to the outbreak of COVID-19 caused by a novel coronavirus SARS-CoV-2, global scientific research institutions and pharmaceutical companies are stepping up related vaccine development and antiviral drug trials. Scientists from multiple countries are working hard to identify drug candidates that can be used for clinical therapy to patients with COVID-19 by screening compound libraries. TargetMol as a drug screening expert quickly generated this compound library to support the research and development of anti-COVID-19 drugs.

This compound library includes Part1 and Part2. Part1 contains compounds that have been demonstrated to have anti-coronavirus activity or are broad-spectrum antiviral agents including Remdesivir, Lopinavir/Ritonavir, Chloroquine diphosphate (combination use with Remdesivir), Polydatin (bind with Mpro), etc. Part2 collects compounds from virtual screening hits based on molecular docking. These compounds with high-affinity to 7 SARS-CoV-2 protein targets (RBD of Spike protein, viral papain like protease (PLpro), main protease (3CLpro, also named 3-chymotrypsin-like protease), RNA-dependent RNA polymerase (RdRp), nsp16 (2′-O-methyltransferase, helicase), nsp15, and X-domain.) and 1 human ACE2 have the potential to provide more drug candidates for molecular and cellular antiviral activity assays.

As a world-renowned supplier of small molecular compounds, TargetMol immediately after the outbreak of COVID-19 performed a Swiss-Model Homology Modelling process to generate reliable protein models or 3D protein structures of these related drug targets. Then structure-based virtual screening was performed against TargetMol libraries (7729 compounds) and Bioactive compound library (7647 compounds) by using Surflex-Dock in the Sybyl-X 2.0 package. About 2000 hits having anti-COVID-19 CADD activity from virtual screening formed Part2 of this compound library. We wish these compounds would speed up the development of COVID-19 targeted drugs. We also will keep updating it in response to the newest research progress.

All products from TargetMol are for Research Use Only. Not for Human or Veterinary or Therapeutic Use.
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Product Description

  • A unique collection of 2446 compounds with confirmed anti-SARS-CoV-2 activity or potential activity and part of them are broad-spectrum antiviral agents;
  • Compounds contain Remdesivir, Lopinavir/Ritonavir, Chloroquine diphosphate (combination use with Remdesivir), Polydatin (bind with Mpro), etc.;
  • Detailed compound information with structure, target, and biological activity description;
  • NMR and HPLC/LCMS validated to ensure high purity and quality.

Library Customization

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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
Request Library Compound List (L1710)

Library Composition

HIV Protease (45)
DNA/RNA Synthesis (37)
Adrenergic Receptor (36)
Endogenous Metabolite (28)
Antibacterial (27)
HCV Protease (27)
5-HT Receptor (24)
Antioxidant (23)
RAAS (22)
AChR (22)
Autophagy (22)
Calcium Channel (20)
Dopamine Receptor (20)
Antibiotic (19)
Antiviral (19)
Potassium Channel (19)
VEGFR (18)
Histamine Receptor (17)
COX (17)
Reverse Transcriptase (17)
Dehydrogenase (16)
PI3K (16)
Histone Methyltransferase (16)
Antifection (14)
P450 (14)
c-Kit (14)
CCR (13)
Epigenetic Reader Domain (13)
Influenza Virus (12)
PDE (12)
EGFR (12)
Prostaglandin Receptor (12)
NF-κB (11)
Sodium Channel (11)
ribosome (11)
Topoisomerase (11)
HBV (10)
CDK (10)
FLT (10)
HDAC (10)
PDGFR (10)
PKC (10)
mTOR (9)
HSV (8)
PPAR (8)
TLR (8)
TNF (8)
Vitamin (8)
Src (8)
Integrin (7)
JAK (7)
Raf (7)
AMPK (7)
Proteasome (7)
c-Met/HGFR (6)
BCL (6)
Estrogen/progestogen Receptor (6)
STAT (6)
Akt (6)
TAM Receptor (6)
ATPase (6)
GABA Receptor (5)
Glucocorticoid Receptor (5)
Glucokinase (5)
DHFR (5)
c-RET (5)
HMG-CoA Reductase (5)
Caspase (5)
Opioid Receptor (5)
P2 Receptor (5)
Parasite (5)
Thrombin (5)
FGFR (5)
Tyrosine Kinases (5)
Adenosine Receptor (5)
Antifungal (5)
MRP (4)
Reductase (4)
Carbonic Anhydrase (4)
Phospholipase (4)
HSP (4)
NADPH (4)
MAO (4)
Transferase (4)
Cysteine Protease (4)
Sirtuin (4)
Bcr-Abl (4)
GSK-3 (4)
MEK (4)
NMDAR (4)
Tyrosinase (4)
CXCR (3)
MMP (3)
S1P Receptor (3)
DNA Alkylation (3)
GPR (3)
ROS (3)
DNA-PK (3)
Serine Protease (3)
GluCls (3)
Gamma-secretase (3)
Ferroptosis (3)
ERK (3)
Microtubule Associated (3)
Norepinephrine (3)
PKA (3)
NOS (3)
Rho (3)
TGF-beta/Smad (3)
Wnt/beta-catenin (3)
Phosphatase (3)
Apoptosis (3)
HER (3)
Acetyl-CoA Carboxylase (2)
LDL (2)
Fatty Acid Synthase (2)
Kinesin (2)
JNK (2)
Gap Junction Protein (2)
lysosomal autophagy (2)
Glutathione reductase (2)
IκB/IKK (2)
Virus Protease (2)
Retinoid Receptor (2)
IL Receptor (2)
IGF-1R (2)
Hydroxylase (2)
ABC (2)
Aromatase (2)
HIF (2)
Telomerase (2)
Amino Acids and Derivatives (2)
PDK (2)
SGLT (2)
p53 (2)
PAI-1 (2)
Chk (2)
PARP (2)
PD-1/PD-L1 (2)
P-gp (2)
OX Receptor (2)
Casein Kinase (2)
CaMK (2)
Trk receptor (2)
BTK (2)
PLK (2)
Proton pump (2)
ATM/ATR (2)
CSF-1R (2)
Lipase (2)
SARS-CoV (2)
Androgen Receptor (2)
DPP-4 (2)
Nucleoside Antimetabolite/Analog (2)
S6 Kinase (2)
DNA Methyltransferase (2)
Neprilysin (1)
Phosphorylase (1)
NAMPT (1)
MNK (1)
Vasopressin Receptor (1)
Nrf2 (1)
NPC1L1 (1)
LPA Receptor (1)
Tie-2 (1)
LTR (1)
Platelet aggregation (1)
TRP/TRPV Channel (1)
PED (1)
NADPH-oxidase (1)
MPO (1)
RAR/RXR (1)
Mdm2 (1)
VDA (1)
MT Receptor (1)
UGT (1)
Ras (1)
NOD-like Receptor (NLR) (1)
Mitophagy (1)
MLK (1)
P2X Receptor (1)
p38 MAPK (1)
Arginase (1)
Lipoxygenase (1)
cell cycle arrest (1)
Decarboxylase (1)
CRM1 (1)
Annexin A (1)
CPT (1)
Syk (1)
Sigma receptor (1)
Chloride channel (1)
CFTR (1)
c-Fms (1)
CETP (1)
Cell wall (1)
Survivin (1)
Discoidin Domain Receptor (DDR) (1)
CaSR (1)
Stemness kinase (1)
Cannabinoid Receptor (1)
cAMP (1)
Antifolate (1)
Bradykinin Receptor (1)
Bombesin Receptor (1)
Stearoyl-CoA Desaturase (SCD) (1)
Aurora Kinase (1)
ATP Citrate Lyase (1)
ASK (1)
Serine/threonin kinase (1)
DNA gyrase (1)
Lipid (1)
GNRH Receptor (1)
LHRH (1)
Thioredoxin (1)
Integrase (1)
ROR (1)
HIF/HIF Prolyl-Hydroxylase (1)
Hck (1)
Guanylate cyclase (1)
GTPase (1)
GST (1)
GPCR19 (1)
gp120/CD4 (1)
Glutaminase (1)
Aminopeptidase (1)
GluR (1)
ACK (1)
GHSR (1)
AhR (1)
FXR (1)
ALK (1)
Thyroid hormone receptor(THR) (1)
Fas/FasL (1)
FAK (1)
FAAH (1)
Endothelin Receptor (1)
E1/E2/E3 Enzyme (1)
Protease-activated Receptor (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