Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9649698 | 0.85 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1LMNACYP1A2CYP3A4 | |
| SCHEMBL5638807 | 0.85 | L3MBTL1 (0.38) | ALDH1A1L3MBTL1BCAT2SLC9A1LMNA | |
| SCHEMBL3721889 | 0.84 | PRKDC (0.36) | ALDH1A1L3MBTL1BCAT2 | |
| SCHEMBL27484504 | 0.83 | BCAT2 (0.44) | ALDH1A1BCAT2LMNA | |
| SCHEMBL8138242 | 0.82 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1BCAT2LMNACYP1A2 | |
| SCHEMBL30595097 | 0.82 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1BCAT2LMNACYP1A2 | |
| SCHEMBL8678853 | 0.81 | SMN1; SMN2 (0.35) | ALDH1A1L3MBTL1LMNAMAPT | |
| SCHEMBL11211669 | 0.81 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1LMNACYP1A2MAPT | |
| SCHEMBL598127 | 0.81 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1BCAT2SLC9A1 | |
| SCHEMBL5473449 | 0.81 | IGF1R (0.33) | ALDH1A1CYP1A2CYP3A4CYP2D6HPGD |
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 |
|---|---|---|---|---|---|---|---|
| JP-3209362-A | — | — | None | — | — | JP | disclosed |
| JP-H03209362-A | 4,4,5-TRIMETHYL-2-(2,3-DIMETHYL-4-METHYLSULFONYLBENZOLY) CYCLOHEXANE-1,3-DIONE, PRODUCTION THEREOF AND USE AS HERBICIDE | NIPPON SODA CO LTD | 1991-09-12 | — | — | JP | disclosed |