Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.49 |
| ▸ | CTSK | P43235 | 5/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 4/20 | 0.37 |
| ▸ | PPARG | P37231 | 3/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8278849 | 0.89 | CTSK (0.46) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL375943 | 0.83 | CTSS (0.57) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL23850037 | 0.83 | CTSS (0.57) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL375942 | 0.83 | CTSS (0.57) | CTSSCTSKIDO1AAK1KMT2A | |
| Hydrochloric Acid SCHEMBL31407550 | 0.82 | CTSS (0.56) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL956164 | 0.81 | CTSS (0.68) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL1351322 | 0.81 | CTSS (0.68) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL956167 | 0.81 | CTSS (0.68) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL16119327 | 0.81 | CTSS (0.52) | CTSSCTSKIDO1AAK1KMT2A | |
| SCHEMBL26120706 | 0.81 | CTSS (0.52) | CTSSCTSKIDO1AAK1KMT2A |
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-2005113580-A1 | ANTICORONVIRAL COMPOUNDS AND COMPOSITIONS, THEIR PHARMACEUTICAL USES AND MATERIALS FOR THEIR SYNTHESIS | PFIZER INC. (US) | 2005-12-01 | — | — | WO | disclosed |