Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.41 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2769683 | 1.00 | KDM1A (0.44) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL2769676 | 1.00 | KDM1A (0.44) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL6900954 | 0.92 | KDM1A (0.48) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL11206059 | 0.92 | KDM1A (0.48) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL23458124 | 0.92 | KDM1A (0.48) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL23458237 | 0.92 | KDM1A (0.48) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL183824 | 0.83 | KDM1A (0.42) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL18714114 | 0.81 | KDM1A (0.46) | KDM1ACES2CES1DEGS1ALDH1A1 | |
| SCHEMBL15958840 | 0.81 | KDM1A (0.41) | KDM1ACES2CES1DEGS1SMN1; SMN2 | |
| SCHEMBL9418459 | 0.81 | ESR1 (0.57) | CES2DEGS1TDP1ESR1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1824952-B1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2010-04-28 | — | — | EP | claimed |