Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27428658 | 0.95 | PKM (0.34) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL16533608 | 0.73 | PKM (0.36) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL1536078 | 0.69 | — | — | |
| SCHEMBL23199589 | 0.68 | TSHR (0.38) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL12699161 | 0.68 | TSHR (0.38) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL1116297 | 0.68 | CYP2C19 (0.40) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL516698 | 0.67 | ALDH1A1 (0.52) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL6874432 | 0.67 | ALDH1A1 (0.52) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL7632840 | 0.67 | ALDH1A1 (0.52) | PKMALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL542223 | 0.66 | — | — |
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-2513098-A1 | AMINOPYRIMIDINES AS SYK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011075515-A1 | AMINOPYRIMIDINES AS SYK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-06-23 | — | — | WO | disclosed |