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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
pH (ITC)
Substrate or Competitor
Compound Mol. Wt.
Chemical Structure
Pathways
Source Organism
Number of Compounds
Monomer List in csv
Het List in SDF
Compound
FDA Drugs
Important Compounds
Chemical Structure
Name
SMILES
Number of Data
/
Targets
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PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
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Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
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Deposition
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Targets Binding with 338 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
cysteine protease ATG4B isoform a
IC50:
342
3
10
2D
3D
TSV
Hormone sensitive lipase
IC50:
410
13
4
2D
3D
TSV
HSL
IC50:
410
13
4
2D
3D
TSV
Prostaglandin E3
Ki:
390
IC50:
126
EC50:
19
21
3
2D
3D
TSV
PTGER3
Ki:
390
IC50:
126
EC50:
19
21
3
2D
3D
TSV
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