Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 3/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.40 |
| ▸ | PPARD | Q03181 | 3/20 | 0.40 |
| ▸ | PPARA | Q07869 | 3/20 | 0.40 |
| ▸ | TOP1 | P11387 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | FABP4 | P15090 | 2/20 | 0.40 |
| ▸ | F7 | P08709 | 2/20 | 0.40 |
| ▸ | F3 | P13726 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1784552 | 1.00 | ALDH1A1 (0.45) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL1784553 | 1.00 | ALDH1A1 (0.45) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL12261542 | 0.93 | PPARG (0.52) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL11009268 | 0.89 | ALDH1A1 (0.56) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL11009265 | 0.89 | ALDH1A1 (0.56) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL1785025 | 0.85 | F7 (0.57) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL1785023 | 0.85 | F7 (0.57) | ALDH1A1PPARGMAPTCYP19A1FFAR1 | |
| SCHEMBL1905069 | 0.84 | — | — | |
| SCHEMBL9651209 | 0.84 | — | — | |
| SCHEMBL1905071 | 0.84 | — | — |
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-0035508-B1 | FLAVOURING UNSATURATED KETONE | FIRMENICH SA (CH) | 1983-05-11 | — | — | EP | disclosed |
| US-3953377-A | Ethyl-2-trans-4-cis undecadienoate, ethyl-2-trans-4-cis dodecadienoate and ethyl-2-decadienoate perfume compositions | FIRMENICH S.A. (CH) | 1976-04-27 | — | — | US | disclosed |