Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | LDHB | P07195 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4485668 | 0.92 | ALDH1A1 (0.39) | ALDH1A1CNR1 | |
| SCHEMBL4490045 | 0.90 | PPARG (0.42) | RAB9AALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL4559834 | 0.90 | PPARG (0.41) | RAB9AALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL4504906 | 0.88 | MEN1 (0.45) | RAB9AALDH1A1CNR1SMN1; SMN2MEN1 | |
| SCHEMBL4492334 | 0.86 | TAAR1 (0.36) | ESR1RAB9ATAAR1MEN1KMT2A | |
| SCHEMBL4504872 | 0.86 | LDHA (0.38) | RAB9ATAAR1MEN1KMT2ANPC1 | |
| SCHEMBL4477477 | 0.85 | TDP1 (0.42) | ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL4491011 | 0.84 | SMN1; SMN2 (0.44) | ESR1ESR2RAB9AALDH1A1CNR1 | |
| SCHEMBL4481909 | 0.83 | KDM4E (0.40) | RAB9AALDH1A1SMN1; SMN2TAAR1MEN1 | |
| SCHEMBL4485206 | 0.83 | ALDH1A1 (0.32) | RAB9AALDH1A1SMN1; SMN2TAAR1MEN1 |
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-7504429-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2009-03-17 | — | — | US | claimed |