Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL173454 | 0.92 | CES1 (0.39) | AKR1C3ALDH1A1CES1CES2TSHR | |
| SCHEMBL238059 | 0.89 | CES1 (0.44) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL1524419 | 0.87 | CES2 (0.46) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL164078 | 0.87 | CES1 (0.42) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL36053 | 0.82 | CES1 (0.46) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL4453783 | 0.81 | CES1 (0.55) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL528366 | 0.79 | CES1 (0.52) | ALDH1A1CES1CES2TSHRALOX15 | |
| Phosphine SCHEMBL28389655 | 0.79 | CES1 (0.52) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL28013116 | 0.79 | CES1 (0.52) | ALDH1A1CES1CES2TSHRALOX15 | |
| SCHEMBL28137597 | 0.78 | TDP1 (0.50) | ALDH1A1CES1CES2TSHRALOX15 |
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-0910587-B1 | POLYMERIZATION WITH LIVING CHARACTERISTICS | DU PONT (US) | 2001-12-12 | — | — | EP | disclosed |