Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7970152 | 0.77 | TP53 (0.31) | TP53 | |
| SCHEMBL4413337 | 0.71 | TP53 (0.44) | TP53CA1CA2SLC7A5 | |
| SCHEMBL23804915 | 0.70 | F2 (0.34) | — | |
| SCHEMBL1620570 | 0.69 | TP53 (0.42) | TP53CA1CA2SLC7A5 | |
| SCHEMBL12239 | 0.69 | — | — | |
| SCHEMBL27472213 | 0.69 | — | — | |
| SCHEMBL18254276 | 0.69 | — | — | |
| SCHEMBL792711 | 0.69 | — | — | |
| SCHEMBL18254275 | 0.69 | — | — | |
| SCHEMBL7372437 | 0.69 | SLC7A5 (0.42) | SLC7A5 |
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 |
|---|---|---|---|---|---|---|---|
| US-8101603-B2 | Tyrosine kinase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2012-01-24 | — | — | US | disclosed |