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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
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Compound
FDA Drugs
Important Compounds
Chemical Structure
Name
SMILES
Number of Data
/
Targets
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Author
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PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
PubMed
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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 2110 Compounds
Target Name
Commercially
Available
Compounds
Protein/Small Molecule
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Ki
IC50
Kd
EC50
k
off
k
on
other
ITC
SDF
TSV
1
CGB-PDE
104
120
1986
5
9
0
0
0
0
0
126
11
2D
3D
TSV
2
cGMP-binding cGMP-specific phosphodiesterase
104
120
1986
5
9
0
0
0
0
0
126
11
2D
3D
TSV
3
cGMP-specific 3',5'-cyclic phosphodiesterase
100
120
1973
5
9
0
0
0
0
0
124
11
2D
3D
TSV
4
PDE5
100
120
1973
5
9
0
0
0
0
0
124
11
2D
3D
TSV
5
PDE5A
100
120
1973
5
9
0
0
0
0
0
124
11
2D
3D
TSV
6
Phosphodiesterase 5 (PDE5)
98
120
1832
5
9
0
0
0
0
0
120
9
2D
3D
TSV
7
Phosphodiesterase 5A
114
139
2156
5
54
0
0
0
0
0
137
11
2D
3D
TSV
8
Phosphodiesterase 5A (PDE5A)
98
120
1832
5
9
0
0
0
0
0
120
9
2D
3D
TSV
Sub total
818
979
15711
40
117
0
0
0
0
0
Total
16847