Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.50 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11044018 | 1.00 | AKR1C3 (0.58) | AKR1C3MAPTBCHEDHODHTRPM8 | |
| SCHEMBL1073512 | 0.83 | MAPT (0.55) | AKR1C3MAPTBCHECYP2C19ALDH1A1 | |
| SCHEMBL4865622 | 0.82 | AKR1C3 (0.58) | AKR1C3MAPTDHODHTRPM8ALDH1A1 | |
| SCHEMBL11561505 | 0.79 | MAPT (0.50) | MAPTBCHECYP2C19ALDH1A1KDM4E | |
| SCHEMBL1649381 | 0.79 | MAPT (0.50) | AKR1C3MAPTBCHECYP2C19ALDH1A1 | |
| SCHEMBL4050625 | 0.79 | MAPT (0.50) | AKR1C3MAPTBCHECYP2C19ALDH1A1 | |
| SCHEMBL11561504 | 0.79 | MAPT (0.50) | MAPTBCHECYP2C19ALDH1A1KDM4E | |
| SCHEMBL27977683 | 0.77 | AKR1C1 (0.59) | AKR1C3MAPTBCHECYP2C19ALDH1A1 | |
| SCHEMBL30495367 | 0.77 | MAPT (0.47) | AKR1C3MAPTBCHEDHODHTRPM8 | |
| SCHEMBL11203024 | 0.77 | MAPT (0.47) | AKR1C3MAPTBCHEDHODHTRPM8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0025599-B1 | BENZOPYRAN COMPOUNDS, USEFUL AS CHEMOTHERAPEUTIC AGENTS | THE WELLCOME FOUNDATION LIMITED (GB) | 1984-12-19 | — | — | EP | disclosed |
| US-4452991-A | OR BENZO(B)INDENO (2,1-E) PYRANS OR BENZO(C)XANTHENES | BATCHELOR JOHN F (GB) | 1984-06-05 | — | — | US | disclosed |
| EP-0025599-A1 | Benzopyran compounds, useful as chemotherapeutic agents | THE WELLCOME FOUNDATION LIMITED (GB) | 1981-03-25 | — | — | EP | disclosed |