Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL12225351 | 0.83 | SOAT1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL14535262 | 0.81 | ALDH1A1 (0.36) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL13636953 | 0.78 | ALDH1A1 (0.34) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL19882382 | 0.76 | ALDH1A1 (0.41) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL22621253 | 0.76 | TSHR (0.38) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL24982752 | 0.75 | GAPDH (0.31) | ALDH1A1CES2CES1 | |
| SCHEMBL23007992 | 0.75 | ALDH1A1 (0.31) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL22043673 | 0.73 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL19003436 | 0.73 | NPSR1 (0.36) | ALDH1A1TSHR | |
| SCHEMBL21443802 | 0.72 | CES2 (0.36) | ALDH1A1CES2CES1FFAR3HDAC3 |
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-3560937-A1 | 18F-LABELED PSMA-TARGETED PET IMAGING AGENTS | Cancer Targeted Technology LLC (US) | 2019-10-30 | — | — | EP | disclosed |