Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | ASAH2 | Q9NR71 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL7901755 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAEPHX2ASAH2TP53 | |
| SCHEMBL13453162 | 0.85 | TAS1R3 (0.40) | ALDH1A1EPHX2ASAH2TP53TSHR | |
| SCHEMBL9004459 | 0.80 | ALDH1A1 (0.53) | ALDH1A1LMNAEPHX2ASAH2TP53 | |
| SCHEMBL9387099 | 0.80 | ALDH1A1 (0.53) | ALDH1A1LMNAEPHX2ASAH2TP53 | |
| SCHEMBL9387096 | 0.80 | ALDH1A1 (0.53) | ALDH1A1LMNAEPHX2ASAH2TP53 | |
| SCHEMBL9004458 | 0.80 | ALDH1A1 (0.53) | ALDH1A1LMNAEPHX2ASAH2TP53 | |
| SCHEMBL7901849 | 0.79 | TERT (0.42) | LMNAMAPTUSP2RECQLCYP1A2 | |
| SCHEMBL7911935 | 0.79 | TERT (0.42) | LMNAMAPTUSP2RECQLCYP1A2 | |
| SCHEMBL346258 | 0.78 | EPHX2 (0.55) | ALDH1A1LMNAEPHX2ASAH2TP53 | |
| SCHEMBL346257 | 0.78 | EPHX2 (0.55) | ALDH1A1LMNAEPHX2ASAH2TP53 |
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-6200254-B1 | PRACTICAL SYNTHETIC ROUTES TO CYCLOALKADIENONES AND SATURATED AND MONO-UNSATURATED MACROCYCLIC KETONES WITH CLAISEN REARRANGEMENT OF BIS ALLYL ALCOHOLS, RING CYCLIZATION REACTION, AND SUBSEQUENT REDUCTION OR DECARBOALKOXYLATION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2001-03-13 | — | — | US | disclosed |