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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
Special tools
3D Structure Series
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SCOP
Citation
Author
Journal/Citation
Institution
PubMed
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US Patent
Special Data Sets
D3R
Host Guest Systems
Prot-Lig Validation Sets
Other Databases
PDB
85%
100%
Seq ID
UniProtKB/Swiss-Prot
UniProtKB/TrEMBL
PubMed
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All Compounds & Data
Target Names &
Ki
IC50
Kd
EC50
ΔG°
ΔH°
-TΔS°
Enter Data
Deposition
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Sent Comments
Targets Binding with 6270 Compounds
Target Name
Commercially
Available
Compounds
Protein/Small Molecule
Other
Articles
UniProtKB/
Swiss-Prot/TrEMBL
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AffyNet
Ki
IC50
Kd
EC50
k
off
k
on
other
ITC
SDF
TSV
1
ABCC1
586
29
446
2
890
0
0
0
0
0
40
11
2D
3D
TSV
2
ATP-binding cassette sub-family C member 1
586
29
451
2
895
0
0
0
0
0
40
12
2D
3D
TSV
3
ATP-binding cassette, sub-family C, member 1 isoform 1
586
29
446
2
890
0
0
0
0
0
40
11
2D
3D
TSV
4
Leukotriene C(4) transporter
586
29
451
2
895
0
0
0
0
0
40
12
2D
3D
TSV
5
LTC4 transporter
586
29
451
2
895
0
0
0
0
0
40
12
2D
3D
TSV
6
MRP
586
29
446
2
890
0
0
0
0
0
40
11
2D
3D
TSV
7
MRP1
586
29
446
2
890
0
0
0
0
0
40
11
2D
3D
TSV
8
Multidrug resistance-associated protein 1
586
29
451
2
895
0
0
0
0
0
40
12
2D
3D
TSV
Sub total
4688
232
3588
16
7140
0
0
0
0
0
Total
10976