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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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Author
Journal/Citation
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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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Targets Binding with 129 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
14 kDa lectin
IC50:
44
Kd:
66
9
5
2D
3D
TSV
Beta-galactoside-binding lectin
IC50:
9
1
1
2D
3D
TSV
C-14
IC50:
9
1
1
2D
3D
TSV
Cav1.3/Cav beta3/Cav alpha2delta complex
Ki:
22
IC50:
130
3
10
2D
3D
TSV
Cdc25C-associated protein kinase 1
Ki:
2
IC50:
51
Kd:
126
17
0
2D
3D
TSV
Galectin CG-1B
IC50:
9
1
1
2D
3D
TSV
Galectin-1
IC50:
35
Kd:
71
9
4
2D
3D
TSV
Gastric Inhibitory Polypeptide Receptor (GIPR)
Ki:
7
IC50:
127
13
8
2D
3D
TSV
MAP-Microtubule Affinity-Regulating Kinase 3 (MARK3)
Ki:
2
IC50:
51
Kd:
126
17
0
2D
3D
TSV
MAP/microtubule affinity-regulating kinase 3 (MARK 3)
Ki:
2
IC50:
51
Kd:
126
17
0
2D
3D
TSV
MARK3
Ki:
2
IC50:
51
Kd:
126
17
0
2D
3D
TSV
NEK6
IC50:
50
Kd:
119
24
9
2D
3D
TSV
Rat brain class D
Ki:
22
IC50:
130
3
10
2D
3D
TSV
RBD
Ki:
22
IC50:
130
3
10
2D
3D
TSV
Serine/threonine-protein kinase c-TAK1
Ki:
2
IC50:
51
Kd:
126
17
0
2D
3D
TSV
Serine/threonine-protein kinase NEK6
IC50:
50
Kd:
119
24
9
2D
3D
TSV
TEC
Ki:
1
IC50:
36
Kd:
128
28
4
2D
3D
TSV
Tyrosine-protein kinase TEC
Ki:
1
IC50:
36
Kd:
137
EC50:
9
29
5
2D
3D
TSV
Tyrosine-protein kinase TEC (TEC)
Ki:
1
IC50:
36
Kd:
128
28
4
2D
3D
TSV