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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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All Compounds & Data
Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
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Deposition
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Targets Binding with 304 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
APNH
IC50:
367
12
5
2D
3D
TSV
CDC-like kinase 2
Ki:
1
IC50:
159
Kd:
151
36
7
2D
3D
TSV
CDC-like kinase 2 (CLK2)
Ki:
1
IC50:
134
Kd:
151
32
5
2D
3D
TSV
CDC2-like kinase 2 (CLK2)
Ki:
1
IC50:
134
Kd:
151
32
5
2D
3D
TSV
Dual specificity protein kinase CLK2
Ki:
1
IC50:
159
Kd:
151
36
7
2D
3D
TSV
Endothelial plasminogen activator inhibitor
IC50:
333
Kd:
15
18
5
2D
3D
TSV
Metallothionein-3
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
Na(+)/H(+) antiporter, amiloride-sensitive
IC50:
367
12
5
2D
3D
TSV
NRH dehydrogenase [quinone] 2
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
NRH:quinone oxidoreductase 2
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
PAI
IC50:
333
Kd:
15
18
5
2D
3D
TSV
PAI-1
IC50:
333
Kd:
15
18
5
2D
3D
TSV
Plasminogen activator inhibitor 1
IC50:
333
Kd:
15
18
5
2D
3D
TSV
Plasminogen activator inhibitor 1 (PAI-1)
IC50:
333
Kd:
13
18
4
2D
3D
TSV
Plasminogen activator inhibitor-1
IC50:
333
Kd:
15
18
5
2D
3D
TSV
Plasminogen activator-1 (PAI-1)
IC50:
333
Kd:
13
18
4
2D
3D
TSV
QR2
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
Quinone reductase 2
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
Quinone reductase 2 (NQO2)
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
Quinone Reductase 2 (QR2)
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV
Reverse transcriptase
Ki:
18
IC50:
470
29
2
2D
3D
TSV
Reverse Transcriptase (A62V)
IC50:
3
1
1
2D
3D
TSV
Reverse Transcriptase (F61A)
IC50:
3
1
1
2D
3D
TSV
Ribosyldihydr-nicotinamide dehydrogenase [quinone]
Ki:
54
IC50:
307
Kd:
4
ITC:
3
24
4
2D
3D
TSV