Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B10 | O60218 | 1/20 | 0.30 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
| ▸ | AKR1C1 | Q04828 | 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 | |
|---|---|---|---|---|
| SCHEMBL14101952 | 0.94 | AKR1B10 (0.32) | AKR1B10AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4721608 | 0.81 | AKR1B10 (0.33) | AKR1B10AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL14101726 | 0.78 | F2 (0.37) | AKR1B10AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL14101964 | 0.75 | — | — | |
| SCHEMBL4722067 | 0.75 | P2RX7 (0.39) | — | |
| SCHEMBL4722070 | 0.75 | P2RX7 (0.39) | — | |
| SCHEMBL14102092 | 0.73 | PDK2 (0.34) | — | |
| SCHEMBL14101906 | 0.72 | PDE4A (0.37) | — | |
| SCHEMBL14101833 | 0.71 | — | — | |
| SCHEMBL4720700 | 0.71 | ITGB2 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |