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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
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Important Compounds
Chemical Structure
Name
SMILES
Number of Data
/
Targets
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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 39 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
Acetyl-Coenzyme A carboxylase 2
IC50:
7
4
1
2D
3D
TSV
Adenylate kinase 3
Ki:
42
5
1
2D
3D
TSV
Adenylate kinase 3 alpha like 1
Ki:
42
5
1
2D
3D
TSV
Adenylate kinase 3 alpha-like 1
Ki:
42
5
1
2D
3D
TSV
AK 3
Ki:
42
5
1
2D
3D
TSV
cAMP-specific 3',5'-cyclic phosphodiesterase 7B
Ki:
5
IC50:
32
16
3
2D
3D
TSV
CD_antigen=CD25
IC50:
39
EC50:
2
1
6
2D
3D
TSV
Chitin synthase 1
Ki:
8
IC50:
35
3
4
2D
3D
TSV
Cystine/glutamate transporter
Ki:
7
IC50:
38
4
3
2D
3D
TSV
Cytosolic inhibitor of Nrf2
IC50:
27
Kd:
17
EC50:
3
5
12
2D
3D
TSV
DNA polymerase delta catalytic subunit
IC50:
21
5
6
2D
3D
TSV
DNA polymerase delta subunit 1
Ki:
2
IC50:
45
13
7
2D
3D
TSV
DNA polymerase subunit delta p125
IC50:
17
4
4
2D
3D
TSV
Enoyl-[acyl-carrier-protein] reductase [NADH]
Ki:
3
IC50:
40
3
4
2D
3D
TSV
fabI
Ki:
3
IC50:
12
2
1
2D
3D
TSV
G protein-coupled receptor 80
Ki:
40
1
1
2D
3D
TSV
Gamma-glutamyltra-speptidase 1
Ki:
6
IC50:
33
3
10
2D
3D
TSV
Glutamate Carboxypeptidase II (GCPII)
IC50:
43
4
0
2D
3D
TSV
GTP:AMP phosphotransferase mitochondrial
Ki:
42
5
1
2D
3D
TSV
IL-2 receptor alpha subunit
IC50:
39
EC50:
2
1
6
2D
3D
TSV
IL-2-RA
IC50:
39
EC50:
2
1
6
2D
3D
TSV
IL2-RA
IC50:
39
EC50:
2
1
6
2D
3D
TSV
INRF2
IC50:
27
Kd:
16
EC50:
3
5
6
2D
3D
TSV
Integrin alpha5beta1
IC50:
42
2
1
2D
3D
TSV
Interleukin-2 receptor alpha chain
IC50:
39
EC50:
2
1
4
2D
3D
TSV
JAK1/TYK2
IC50:
44
4
2
2D
3D
TSV
KEAP1
IC50:
27
Kd:
16
EC50:
3
5
6
2D
3D
TSV
Kelch-like ECH-associated protein 1
IC50:
27
Kd:
17
EC50:
3
5
12
2D
3D
TSV
Kelch-like protein 19
IC50:
27
Kd:
16
EC50:
3
5
6
2D
3D
TSV
Kiaa0132
Kd:
1
1
7
2D
3D
TSV
KLHL19
IC50:
27
Kd:
16
EC50:
3
5
6
2D
3D
TSV
Kruppel-like factor 5
IC50:
39
2
6
2D
3D
TSV
Motilin
Ki:
60
7
9
2D
3D
TSV
MurC
IC50:
40
4
3
2D
3D
TSV
MurC (E. coli)
IC50:
40
4
3
2D
3D
TSV
MurC (K. pneumoniae)
IC50:
1
1
0
2D
3D
TSV
MurC (P. mirabilis)
IC50:
1
1
1
2D
3D
TSV
Phosphodiesterase 7B
Ki:
5
IC50:
32
16
3
2D
3D
TSV
Phosphodiesterase 7B (PDE7B)
Ki:
5
IC50:
32
16
3
2D
3D
TSV
POLD
IC50:
21
5
6
2D
3D
TSV
POLD1
IC50:
17
4
4
2D
3D
TSV
Promotilin
Ki:
60
7
9
2D
3D
TSV
Prostate-specific membrane antigen (PSMA)
IC50:
43
4
0
2D
3D
TSV
Type-2 restriction enzyme EcoRI
IC50:
39
2
1
2D
3D
TSV
UDP-N-acetylmuramate--L-alanine ligase
IC50:
42
4
4
2D
3D
TSV