Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5822574 | 1.00 | ALDH1A1 (0.33) | ALDH1A1TSHRKDM4E | |
| SCHEMBL9454927 | 0.78 | ESR1 (0.38) | ALDH1A1TSHRKDM4E | |
| SCHEMBL5819699 | 0.76 | KDM4E (0.34) | ALDH1A1TSHRKDM4E | |
| SCHEMBL5819697 | 0.76 | KDM4E (0.34) | ALDH1A1TSHRKDM4E | |
| SCHEMBL1258398 | 0.71 | TSHR (0.42) | ALDH1A1TSHR | |
| SCHEMBL6792543 | 0.68 | TP53 (0.39) | ALDH1A1TSHR | |
| SCHEMBL5819307 | 0.68 | MEN1 (0.33) | KDM4E | |
| SCHEMBL5819315 | 0.68 | MEN1 (0.33) | KDM4E | |
| SCHEMBL73858 | 0.67 | L3MBTL1 (0.45) | ALDH1A1TSHR | |
| SCHEMBL11147538 | 0.67 | ATM (0.33) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006138475-A2 | MAO-B INHIBITORS USEFUL FOR TREATING OBESITY | JENRIN DISCOVERY (US) | 2006-12-28 | — | — | WO | claimed |
| WO-2006138475-A2 | MAO-B INHIBITORS USEFUL FOR TREATING OBESITY | JENRIN DISCOVERY (US) | 2006-12-28 | — | — | WO | disclosed |