Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | ENPEP | Q07075 | 3/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 2/20 | 0.34 |
| ▸ | GABRD | O14764 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5334204 | 0.81 | ALDH1A1 (0.62) | ALDH1A1ENPEPMETAP1S1PR2S1PR1 | |
| SCHEMBL466531 | 0.79 | ALDH1A1 (0.85) | ALDH1A1ENPEP | |
| SCHEMBL18751736 | 0.78 | ENPEP (0.43) | ALDH1A1LTA4HENPEPMETAP1S1PR2 | |
| SCHEMBL102831 | 0.75 | — | — | |
| SCHEMBL13090411 | 0.74 | ALDH1A1 (0.55) | ALDH1A1ENPEPS1PR2S1PR1S1PR3 | |
| SCHEMBL19704888 | 0.74 | CES2 (0.42) | ALDH1A1CES2 | |
| SCHEMBL25660579 | 0.73 | GSR (0.52) | LTA4H | |
| SCHEMBL18768895 | 0.73 | ANPEP (0.36) | ALDH1A1LTA4HENPEPMETAP1S1PR2 | |
| SCHEMBL14713826 | 0.73 | ALDH1A1 (0.69) | ALDH1A1LTA4HENPEPMETAP1S1PR2 | |
| SCHEMBL1873964 | 0.73 | ALDH1A1 (0.96) | ALDH1A1ENPEP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009061597-A1 | COMPOUNDS FOR INHIBITING KSP KINESIN ACTIVITY | SCHERING CORPORATION (US) | 2009-05-14 | — | — | WO | disclosed |