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Search for Building Blocks
Substructure Search for Screening Compounds
Focused and targeted libraries
Protein-Protein Interaction Library
222,500
PPI Helix Turn 3D-Mimetics Library
74,000
Peptidomimetic Library
38,400
PDZ PPI Library
4,000
Nonpeptide Peptidomimetics PPI Library
19,400
Cyclic Ugi PPI Library
10,000
Alpha-Helix Mimetics Library
28,000
Peptidomimetics of Beta-Turn Motifs Library
2,679
Macrocycles Library
3,300
3D Mimetics PPI Library
2,000
Recognition Elements PPI Library
26,000
Bcl2-PPI Inhibitors Library
11,000
Inhibitors of beta-Catenin Signaling
8,000
MDM2-p53 interaction inhibitors Library
23,000
SH2 PTB Focused Library
7,000
Nucleoside Mimetics Library
2,600
Purine Based Nucleoside Mimetics Library
1,300
CNS MPO Library
30,000
CNS Library
26,000
GABA Library
7,271
Purinergic Library
3,500
Neurotransmitter Transporter Inhibitors Library
12,000
Ligand-Gated Ion Channels Library
4,000
Voltage-Gated Ion Channel-Targeted Library
5,000
GPCR Targeted Library
40,000
Protein Kinases Inhibitors Library
38,000
Akt-Targeted Library
12,000
Allosteric Kinases Inhibitors Library
26,000
Aurora A-B Kinases Targeted Library
10,000
KRAS-Targeted Library
11,000
Proline Kinase Library
2,000
Type II Kinase Inhibitors Library
8,000
C-Met Library
16,000
PI3K-Targeted Library
19,000
Antiviral Library
87,043
Anti-HIV1 Library
21,000
Antiviral HBV Library
11,000
CORONAVIRUS Library
21,145
Androgen Receptor Antagonists Library
4,300
Anticancer Library
65,000
Antimitotic Tubulin Library
18,000
Developmental Pathway (Hh/Wnt) Set
2,000
MEF2-HDAC (class II) Modulators Library
6,000
Cysteine Proteases Inhibitors Library
8,000
Serine Proteases Inhibitors Library
37,000
Protein Arginine Methyltransferases Library
31,000
Immunological Library
7,300
PD-1/L1 Library
500
TLR-8 ligands Library
900
Anti-Inflammatory Library
28,000
See all >
Active Reference Sets
Human GPCR Annotated Library
5,800
CNS Annotated Library
733
Human Phosphatases Annotated Library
225
Human Receptors Annotated Library
5,600
Human Transcription Factors Annotated Library
5,278
Human Proteases Annotated Library
3,000
Human Ion Channels Annotated Library
400
Human Kinases Annotated Library
2,585
CNS targets activity set
7,000
Selective Target Activity Profiling Library
15,526
Therapeutical Diversity Annotated Library
8,500
ChemoGenomic Annotated Library for Phenotypic Screening
99,500
3D-Biodiversity Library
34,000
Target Identification, Phenotypic Screening library (TIPS)
35,000
Launched & Clinically Evaluated Drugs Library
202
Antiviral Annotated Library
22,775
Opportunistic Pathogens of Immunocompromised Hosts Annotated Library
2,100
See all >
Diversity libraries
Representative Diversity Libraries
50,000 / 100,000 / 150,000
SmartTM Library
54,000
Soluble Diversity Library
9,500
Targeted Diversity Library
45,000
MCE-18 Trends in Medicinal Chemistry
50,000
3D-Diversity Natural-Product-Like Library
21,000
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm)
300,000
3D-Pharmacophore Based Diversity Library
52,000
See all >
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Protein Kinases Inhibitors Library
38,000 compounds
Protein Kinases Inhibitors Library is modulators that are used in cancer and inflammation treatment.
Receptor protein tyrosine phosphatases
3,900 compounds
RPTP Targeted Library is small-molecule inhibitors. Disruption of protein tyrosine phosphorylation contributes to a variety of human diseases.
Cysteine Proteases Inhibitors Library
8,000 compounds
Set of small-molecule compounds that can target cysteine proteases and be used in drug development for cancer, viral, infections treatment.
Akt-Targeted Library
12,000 compounds
Akt Targeted Library is a set of small-molecule inhibitors of the Akt-signaling network. These inhibitors are widely used in cancer treatment.
C-Met Library
16,000 compounds
Molecules from c-Met Library target receptor tyrosine kinase. It prevents binding hepatocyte growth factor with c-Met which can lead to cancer.
Serine Proteases Inhibitors Library
37,000 compounds
Serine Proteases Inhibitors Library is a set of small-molecule compounds that target serine proteases and can be used in anticancer drug discovery.
Protein Arginine Methyltransferases Library
31,000 compounds
PRMT Library is set of small-molecule compounds with reported affinity against cancer-assosiated PRMTs.
Regenerative Medicine Focused Library
23,000 compounds
Regenerative Medicine Focused Library is a chemical space that includes promoters of regeneration. They help to repair diseased organs or tissues.
PI3K-Targeted Library
19,000 compounds
PI3K-Targeted Library is a set of small-molecule inhibitors of PI3K signaling pathway. They can be used in effective inhibiting tumor progression.
DGK Inhibitors Library
12,000 compounds
Diacylglycerol kinase Inhibitors Library is a set of small-molecules that can inhibit the progression of cancer and innate cytotoxic immunocytes.
Proline Kinase Library
2,000 compounds
Proline Kinase Library is a set of kinase inhibitors. These kinases play a crucial role in diverse cellular processes and human diseases.
Adenosine Receptors Targeted Library
21,000 compounds
Adenosine Receptors Targeted Library is a set of small-molecule ligands. They can be used for treating neurodegeneration diseases.
Autophagy-Targeted Library
17,000 compounds
Autophagy-Targeted Library is a set of small-molecule modulators for the regulation of autophagy.
Chelators targeting matrix metalloproteinases library
9,300 compounds
Chelators targeting matrix metalloproteinases are small-molecule that inhibit proteolytic activity of tumor cells and prevent metastasis.
Aurora A-B Kinases Targeted Library
10,000 compounds
Set of small-molecule serine/threonine kinases family inhibitors.
Developmental Pathway (Hh/Wnt) Set
2,000 compounds
Developmental Pathway Hh/Wnt Set is inhibitors of the Hedgehog and Wnt-signaling pathways implicated in cancer.
Antimitotic Tubulin Library
18,000 compounds
Antimitotic Tubulin Library is a set of small-molecule tubulin binders. These inhibitors are potential antimitotic drugs for anticancer therapy.
Type II Kinase Inhibitors Library
8,000 compounds
Type II Kinase Inhibitors Library is a set of non-ATP site inhibitors or activators that bind to an extended ATP site including a back pocket.
MCL1 Targeted Library
12,000 compounds
Set of small-molecule compounds that inhibit MCL1 thus restoring the apoptotic pathway in tumor cells.
KRAS-Targeted Library
11,000 compounds
KRAS-Targeted Library is a set of novel KRAS-active compounds.
Integrin Receptors Targeted library
2,000 compounds
Integrin Receptors Targeted library is a set of RGD peptides or peptidomimetics that affect many events in tumor cells thereby directly induce apoptosis.
Inhibitors of beta-Catenin Signaling
8,000 compounds
Inhibitors of beta-Catenin Signaling is small molecules that target PPI of beta-catenin with other proteins involved in significant physiological processes.
Hsp90-Targeted Library
13,000 compounds
Heat shock protein 90 Targeted Library is a set of small-molecule modulators that inhibit the activity of HSP90/70 and can be used as anticancer drugs.
Indoleamine 2,3-dioxygenase 1 Focused Library
6,000 compounds
Indoleamine 2,3-dioxygenase1 Focused Library is a set of small-molecule compounds that can inhibit inappropriate IDO activity in tumours.
Neuropeptide S Library
3,000 compounds
Neuropeptide S Library is a set of small-molecule NPSR ligands. They can be used in psychiatric disorders treatment as anxiolytics and analgesics.
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