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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
Institution
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PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
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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 1539 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
Alpha 1B-adrenoceptor
Ki:
1413
IC50:
126
Kd:
65
EC50:
230
179
3
2D
3D
TSV
Alpha 1B-adrenoreceptor
Ki:
1413
IC50:
126
Kd:
65
EC50:
230
179
3
2D
3D
TSV
Alpha adrenergic receptor 1A and 1B
Ki:
115
IC50:
27
Kd:
52
EC50:
3
39
0
2D
3D
TSV
Alpha-1Adrenoceptor
Ki:
115
IC50:
27
Kd:
52
EC50:
3
39
0
2D
3D
TSV
Alpha-1B adrenoreceptor
Ki:
115
IC50:
27
Kd:
52
EC50:
3
39
0
2D
3D
TSV
I kappa-B kinase epsilon
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
I-kappa-B Kinase 3 (IKK-epsilon)
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
I-kappa-B kinase epsilon (IKK-E)
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
I-kappa-B kinase epsilon (IKKE)
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
IkBKE
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
IKK-E
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
IKK-epsilon
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
IKK-i
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
Inducible I kappa-B kinase
IC50:
1424
Kd:
126
30
6
2D
3D
TSV
Inhibitor of nuclear factor kappa-B kinase subunit epsilon
IC50:
1424
Kd:
126
30
6
2D
3D
TSV