Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | UBE2N | P61088 | 1/20 | 0.34 |
| ▸ | IL6ST | P40189 | 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 | |
|---|---|---|---|---|
| SCHEMBL23925665 | 0.85 | CES1 (0.36) | CES2CES1ALDH1A1TP53 | |
| SCHEMBL7044114 | 0.84 | ALDH1A1 (0.36) | ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL30184919 | 0.83 | GPR84 (0.40) | CES2CES1ALDH1A1 | |
| SCHEMBL30184915 | 0.81 | GPR84 (0.48) | LMNASPHK1MAPT | |
| SCHEMBL13715915 | 0.78 | CES2 (0.39) | CES2CES1 | |
| SCHEMBL23925683 | 0.78 | TSHR (0.36) | CES2CES1ALDH1A1CYP3A4MEN1 | |
| SCHEMBL22883546 | 0.77 | — | — | |
| SCHEMBL14091098 | 0.77 | — | — | |
| SCHEMBL30184911 | 0.76 | CES2 (0.41) | CES2CES1ALDH1A1 | |
| SCHEMBL6522673 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003018521-A1 | SUBSTITUTED ALKENE DIOLS | ISIS INNOVATION LIMITED (GB) | 2003-03-06 | — | — | WO | disclosed |