Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 8/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.31 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.31 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27676062 | 1.00 | GSK3B (0.35) | GSK3BIDH1TRIM24TRIM33TNKS2 | |
| SCHEMBL27676121 | 1.00 | GSK3B (0.35) | GSK3BIDH1TRIM24TRIM33TNKS2 | |
| SCHEMBL27600814 | 0.79 | GSK3B (0.32) | GSK3B | |
| Hydrochloric Acid SCHEMBL27619412 | 0.78 | GSK3B (0.31) | GSK3B | |
| SCHEMBL27458227 | 0.78 | GSK3B (0.35) | GSK3BIDH1TRIM24TRIM33TNKS2 | |
| SCHEMBL24096704 | 0.76 | IDH1 (0.36) | GSK3BIDH1 | |
| SCHEMBL27299860 | 0.76 | GAA (0.46) | — | |
| SCHEMBL4183810 | 0.75 | GSK3B (0.34) | GSK3BIDH1TNKS2 | |
| Hydrochloric Acid SCHEMBL27619269 | 0.74 | GAA (0.45) | — | |
| SCHEMBL27798345 | 0.72 | CD44 (0.30) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101001841-A | Tetrahydroquinolones and aza-analogues thereof useful as DPP-IV inhibitors for the treatment of diabetes | ASTRAZENECA AB (SE) | 2007-07-18 | — | — | CN | disclosed |