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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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Journal/Citation
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PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
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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 319 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
CD45
Ki:
35
IC50:
318
45
7
2D
3D
TSV
ENT1
Ki:
181
IC50:
163
Kd:
6
Other:
13
12
6
2D
3D
TSV
Equilibrative NBMPR-sensitive nucleoside transporter
Ki:
181
IC50:
163
Kd:
6
Other:
13
12
6
2D
3D
TSV
Equilibrative nitrobenzylm-rcaptopurine riboside-sensitive nucleoside transporter
Ki:
181
IC50:
163
Kd:
6
Other:
13
12
6
2D
3D
TSV
Equilibrative Nucleoside Transporter 1 (ENT1)
Ki:
181
IC50:
163
Kd:
6
Other:
13
12
6
2D
3D
TSV
Leukocyte common antigen
Ki:
35
IC50:
318
45
7
2D
3D
TSV
Leukocyte common antigen
Ki:
35
IC50:
318
45
7
2D
3D
TSV
Mevalonate kinase
IC50:
1
1
1
2D
3D
TSV
Nucleoside transporter, es-type
Ki:
181
IC50:
163
Kd:
6
Other:
13
12
6
2D
3D
TSV
putative hexokinase HKDC1
IC50:
433
EC50:
104
3
0
2D
3D
TSV
Receptor-type tyrosine-protein phosphatase C
Ki:
35
IC50:
318
45
7
2D
3D
TSV
Receptor-type tyrosine-protein phosphatase C (CD45)
Ki:
35
IC50:
318
45
7
2D
3D
TSV
Solute carrier family 29 member 1
Ki:
181
IC50:
163
Kd:
6
Other:
13
12
6
2D
3D
TSV
TACR2
Ki:
76
IC50:
86
Kd:
83
EC50:
46
43
4
2D
3D
TSV
Tyrosine-Protein Phosphatase (CD45)
Ki:
35
IC50:
318
45
7
2D
3D
TSV