Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.34 |
| ▸ | PPARG | P37231 | 3/20 | 0.34 |
| ▸ | OXER1 | Q8TDS5 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | RXRA | P19793 | 2/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.34 |
| ▸ | F7 | P08709 | 3/20 | 0.32 |
| ▸ | F3 | P13726 | 3/20 | 0.32 |
| ▸ | PPARA | Q07869 | 3/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1782249 | 0.82 | GGPS1 (0.36) | MAPTLMNAALOX15RECQLBLM | |
| SCHEMBL1782250 | 0.82 | GGPS1 (0.36) | MAPTLMNAALOX15RECQLBLM | |
| SCHEMBL19359606 | 0.79 | ALDH1A1 (0.33) | ALDH1A1CYP19A1PPARGOXER1MAPT | |
| SCHEMBL16744343 | 0.76 | ALDH1A1 (0.35) | ALDH1A1CYP19A1PPARGOXER1MAPT | |
| SCHEMBL2882121 | 0.76 | ALDH1A1 (0.48) | ALDH1A1CYP19A1PPARGOXER1MAPT | |
| SCHEMBL16577213 | 0.76 | CYP1A2 (0.33) | ALDH1A1CYP19A1PPARGOXER1MAPT | |
| SCHEMBL18092737 | 0.76 | ACLY (0.34) | PPARGPPARAPPARDCNR1CNR2 | |
| SCHEMBL6391698 | 0.72 | — | — | |
| SCHEMBL2050434 | 0.71 | ALDH1A1 (0.36) | ALDH1A1CYP19A1PPARGOXER1MAPT | |
| SCHEMBL17808378 | 0.71 | ACLY (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110191877-A | Cleavable surfactants | 弗门尼舍有限公司 | 2019-08-30 | — | — | CN | disclosed |
| EP-2152673-A2 | 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES | Firmenich S.A. (CH) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008142591-A2 | 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES | FIRMENICH SA (CH) | 2008-11-27 | — | — | WO | disclosed |