Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 6/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | KMO | O15229 | 2/20 | 0.44 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30705023 | 0.84 | MKNK1 (0.56) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL10364611 | 0.84 | MKNK1 (0.56) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL28019336 | 0.82 | MKNK1 (0.58) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL28297134 | 0.78 | CYP3A4 (0.46) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL7430896 | 0.76 | CYP2A6 (0.53) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL2265522 | 0.74 | KDM4C (0.47) | ALDH1A1MKNK1MKNK2SIRT3KDM4E | |
| SCHEMBL10968862 | 0.74 | HTT (0.54) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 | |
| SCHEMBL2222831 | 0.74 | ALDH1A1 (0.50) | ALDH1A1SLC22A12KDM4EMAPTHTT | |
| SCHEMBL6180804 | 0.73 | TDP1 (0.66) | ALDH1A1MKNK1MKNK2SIRT3KDM4E | |
| SCHEMBL1173860 | 0.73 | HTT (0.56) | CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1183239-A1 | AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR | G.D. SEARLE & CO. (US) | 2002-03-06 | — | — | EP | disclosed |
| WO-2000069821-A1 | AROMATIC SULFONE HYDROXAMIC ACID METALLOPROTEASE INHIBITOR | G.D. SEARLE & CO. (US) | 2000-11-23 | — | — | WO | disclosed |