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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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85%
100%
Seq ID
UniProtKB/Swiss-Prot
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Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
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Targets Binding with 170 Compounds
Target Name
Affinity Link(s)
Article(s)
UniProt
Files
90 kDa ribosomal protein S6 kinase 1
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
Chitinase
Ki:
8
IC50:
193
Kd:
4
16
14
2D
3D
TSV
Dgat2l5
IC50:
2
1
1
2D
3D
TSV
GABA A Alpha2Beta1Gamma2
Ki:
109
IC50:
15
EC50:
30
10
5
2D
3D
TSV
GABA receptor alpha-2 subunit
Ki:
138
IC50:
16
EC50:
31
18
6
2D
3D
TSV
Gamma-aminobutyric acid receptor subunit alpha-2 (GABRA2)
Ki:
109
IC50:
15
EC50:
30
10
5
2D
3D
TSV
MAP kinase-activated protein kinase 1a
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
MAP-2
IC50:
127
EC50:
60
7
6
2D
3D
TSV
MAP2
IC50:
127
EC50:
60
7
6
2D
3D
TSV
MAPKAPK1A
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
Mgat1l
IC50:
2
1
1
2D
3D
TSV
Microtubule-associated protein 2
IC50:
127
EC50:
60
7
6
2D
3D
TSV
MOGAT2
IC50:
192
5
7
2D
3D
TSV
Monoacylglycerol O-acyltransferase 1-like
IC50:
2
1
1
2D
3D
TSV
NCE103
Ki:
182
9
3
2D
3D
TSV
p90-RSK 1
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
p90S6K
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
pp90RSK1
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
Ribosomal protein S6 kinase alpha-1
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV
Ribosomal S6 Kinase 1 (RSK-1)
Ki:
18
IC50:
94
Kd:
236
42
12
2D
3D
TSV