Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 12/20 | 0.50 |
| ▸ | ITGA2B | P08514 | 12/20 | 0.50 |
| ▸ | CTSK | P43235 | 3/20 | 0.46 |
| ▸ | CTSS | P25774 | 2/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | ACE | P12821 | 1/20 | 0.45 |
| ▸ | CPA1 | P15085 | 1/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | ITGAV | P06756 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8892727 | 0.92 | ITGB3 (0.55) | ITGB3ITGA2BCTSKCTSSCTSB | |
| SCHEMBL8492505 | 0.81 | MME (0.64) | ITGB3ITGA2BMMEACECPA1 | |
| SCHEMBL8893631 | 0.81 | PSEN1 (0.53) | — | |
| SCHEMBL8893043 | 0.80 | PSEN1 (0.51) | — | |
| SCHEMBL8734217 | 0.80 | REN (0.46) | ITGB3ITGA2BCTSKCTSSCTSB | |
| SCHEMBL7388307 | 0.79 | CTSK (0.51) | CTSKCTSSCTSBCTSL | |
| SCHEMBL8893564 | 0.79 | PSEN1 (0.40) | MMEACECPA1ACE2PTPN1 | |
| SCHEMBL25287172 | 0.78 | ECE1 (0.61) | CTSKCTSSCTSBMMECTSL | |
| SCHEMBL3058668 | 0.78 | ECE1 (0.61) | CTSKCTSSCTSBMMECTSL | |
| SCHEMBL8893516 | 0.78 | CASP3 (0.51) | CTSKCTSSCTSBMMECTSL |
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 |
|---|---|---|---|---|---|---|---|
| US-5643878-A | TREATMENT OF RETROVIRAL DISEASES LIKE AIDS | CIBA-GEIGY CORPORATION (US) | 1997-07-01 | — | — | US | disclosed |
| EP-0618222-A2 | Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid | CIBA-GEIGY AG (CH) | 1994-10-05 | — | — | EP | disclosed |