Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.45 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22677330 | 0.80 | SMN1; SMN2 (0.62) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL22675343 | 0.80 | SMN1; SMN2 (0.62) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL13102175 | 0.80 | SMN1; SMN2 (0.62) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL7402269 | 0.78 | SIGMAR1 (0.54) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL14554075 | 0.77 | S1PR5 (0.56) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL13766174 | 0.77 | S1PR5 (0.56) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL7398354 | 0.77 | S1PR5 (0.44) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL7411706 | 0.73 | SIGMAR1 (0.48) | BCHES1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL13739335 | 0.72 | SMN1; SMN2 (0.57) | S1PR5S1PR4S1PR1S1PR3SMN1; SMN2 | |
| SCHEMBL934458 | 0.72 | SMN1; SMN2 (0.57) | S1PR5S1PR4S1PR1S1PR3SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0776324-A1 | ENDOTHELIN ANTAGONISTS | Abbott Laboratories (US) | 1997-06-04 | — | — | EP | claimed |
| WO-1996006095-A1 | ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 1996-02-29 | — | — | WO | claimed |