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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
UniProtKB/TrEMBL
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Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
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Targets Binding with 162 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
Acetylcholine Binding protein
Ki:
284
IC50:
2
Kd:
45
14
2
2D
3D
TSV
Acetylcholine-binding protein
Ki:
151
Kd:
45
12
1
2D
3D
TSV
Acetylcholine-binding protein (AchBP)
Ki:
151
Kd:
45
12
1
2D
3D
TSV
Acetylcholine-binding protein (Ls-AchBP)
Ki:
151
Kd:
45
12
1
2D
3D
TSV
ACh-binding protein
Ki:
151
Kd:
45
12
1
2D
3D
TSV
AchBP
Ki:
151
Kd:
45
12
1
2D
3D
TSV
BR140
Ki:
1
IC50:
94
Kd:
33
13
6
2D
3D
TSV
Bromodomain and PHD finger-containing protein 1
Ki:
1
IC50:
94
Kd:
33
13
6
2D
3D
TSV
BRPF1
Ki:
1
IC50:
94
Kd:
33
13
6
2D
3D
TSV
IK1
IC50:
175
8
3
2D
3D
TSV
IKCa1
IC50:
175
8
3
2D
3D
TSV
Intermediate conductance calcium-activated potassium channel protein 4
IC50:
175
8
3
2D
3D
TSV
KCa4
IC50:
175
8
3
2D
3D
TSV
N-acylsphingosine-amidohydrolase
IC50:
189
10
5
2D
3D
TSV
Niemann-Pick C1-like protein 1
Ki:
33
IC50:
114
EC50:
33
6
11
2D
3D
TSV
Peregrin
Ki:
1
IC50:
94
Kd:
33
13
6
2D
3D
TSV
Phosphodiesterase 4 (PDE4)
IC50:
167
1
1
2D
3D
TSV
Protein Br140
Ki:
1
IC50:
94
Kd:
33
13
6
2D
3D
TSV
Putative Gardos channel
IC50:
175
8
3
2D
3D
TSV
Retinoid-related orphan receptor gamma (RORγ-LBD)
IC50:
278
1
0
2D
3D
TSV
SK4
IC50:
175
8
3
2D
3D
TSV
Thymidine kinase, cytosolic
Ki:
83
IC50:
153
20
10
2D
3D
TSV
Tk-1
Ki:
2
1
5
2D
3D
TSV
TK1
Ki:
22
1
1
2D
3D
TSV