Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.55 |
| ▸ | CTSK | P43235 | 5/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | CTSS | P25774 | 5/20 | 0.50 |
| ▸ | CTSL | P07711 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CTSB | P07858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7328660 | 1.00 | LTA4H (0.55) | LTA4HCTSKCA12CA1CA2 | |
| SCHEMBL7324719 | 0.88 | SLC15A1 (0.53) | CTSKCA12CA1CA2CA9 | |
| SCHEMBL7324724 | 0.88 | SLC15A1 (0.53) | CTSKCA12CA1CA2CA9 | |
| SCHEMBL20272571 | 0.87 | CTSK (0.55) | CTSKATMCTSSCTSLNPC1 | |
| SCHEMBL27650911 | 0.87 | ATM (0.51) | CTSKCA12CA1CA2CA9 | |
| SCHEMBL9713347 | 0.87 | CTSS (0.53) | CTSKCA12CA1CA2CA9 | |
| SCHEMBL9487552 | 0.87 | CTSS (0.53) | CTSKCA12CA1CA2CA9 | |
| SCHEMBL9487560 | 0.87 | CTSS (0.53) | CTSKCA12CA1CA2CA9 | |
| SCHEMBL28380964 | 0.87 | CTSS (0.53) | CTSKCA12CA1CA2CA9 | |
| Water SCHEMBL10978142 | 0.85 | CTSS (0.55) | CTSKCA12CA1CA2CA9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628035-A4 | RETROVIRAL PROTEASE INHIBITORS. | SMITHKLINE BEECHAM CORP (US) | 1995-03-29 | — | — | EP | disclosed |
| EP-0628035-A1 | RETROVIRAL PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-12-14 | — | — | EP | disclosed |
| WO-1993017003-A1 | RETROVIRAL PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1993-09-02 | — | — | WO | disclosed |