Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | BTN3A1 | O00481 | 2/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.42 |
| ▸ | NDUFS8 | O00217 | 1/20 | 0.42 |
| ▸ | COXFA4 | O00483 | 1/20 | 0.42 |
| ▸ | NDUFAB1 | O14561 | 1/20 | 0.42 |
| ▸ | NDUFA1 | O15239 | 1/20 | 0.42 |
| ▸ | NDUFS4 | O43181 | 1/20 | 0.42 |
| ▸ | NDUFB5 | O43674 | 1/20 | 0.42 |
| ▸ | NDUFB3 | O43676 | 1/20 | 0.42 |
| ▸ | NDUFC1 | O43677 | 1/20 | 0.42 |
| ▸ | NDUFA2 | O43678 | 1/20 | 0.42 |
| ▸ | NDUFS5 | O43920 | 1/20 | 0.42 |
| ▸ | NDUFS7 | O75251 | 1/20 | 0.42 |
| ▸ | NDUFS2 | O75306 | 1/20 | 0.42 |
| ▸ | NDUFS6 | O75380 | 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 | |
|---|---|---|---|---|
| SCHEMBL11294662 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRBTN3A1AOC3ALOX15 | |
| SCHEMBL11262257 | 0.84 | LTA4H (0.43) | HTTLMNACYP2C19 | |
| SCHEMBL11269821 | 0.84 | PPARG (0.44) | ALDH1A1AOC3MTNR1AMTNR1BPPARD | |
| SCHEMBL11250592 | 0.84 | MAOB (0.46) | ALDH1A1L3MBTL1PPARDPPARAPPARG | |
| SCHEMBL11262254 | 0.84 | LTA4H (0.43) | HTTLMNACYP2C19 | |
| SCHEMBL11250596 | 0.84 | MAOB (0.46) | ALDH1A1L3MBTL1PPARDPPARAPPARG | |
| SCHEMBL11269815 | 0.84 | PPARG (0.44) | ALDH1A1AOC3MTNR1AMTNR1BPPARD | |
| SCHEMBL11253943 | 0.82 | TDP1 (0.46) | ALDH1A1TSHRMTNR1AL3MBTL1PPARD | |
| SCHEMBL11253941 | 0.82 | TDP1 (0.46) | ALDH1A1TSHRMTNR1AL3MBTL1PPARD | |
| SCHEMBL11259957 | 0.82 | LMNA (0.51) | ALDH1A1TSHRMTNR1AMTNR1BLMNA |
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-0046282-A2 | 4-Phenoxy-2-butene derivatives and their use as plant growth regulators | J.T. Baker Chemical Co. (US) | 1982-02-24 | — | — | EP | disclosed |
| US-4009202-A | 2(OR 3)-METHYL-1-ACETOXY-4-ALKOXY (OR PHENOXY)-1,3-BUTADIENES | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1977-02-22 | — | — | US | disclosed |