Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Fenipentol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NAAA | Q02083 | 2/20 | 0.49 |
| ▸ | CERT1 | Q9Y5P4 | 3/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Fenipentol SCHEMBL11351770 | 0.92 | LMNA (0.64) | ALDH1A1KDM4ELMNAASAH1POLB | |
| Fenipentol SCHEMBL21837 | 0.92 | LMNA (0.64) | ALDH1A1KDM4ELMNAASAH1POLB | |
| Fenipentol SCHEMBL11573151 | 0.92 | LMNA (0.64) | ALDH1A1KDM4ELMNAASAH1POLB | |
| Acetic Acid SCHEMBL29265549 | 0.90 | LMNA (0.57) | ALDH1A1KDM4ELMNAASAH1RIPK1 | |
| Acetic Acid SCHEMBL29265550 | 0.90 | LMNA (0.57) | ALDH1A1KDM4ELMNAASAH1RIPK1 | |
| Fenipentol SCHEMBL29913852 | 0.90 | LMNA (0.61) | ALDH1A1KDM4ELMNAASAH1POLB | |
| Fenipentol SCHEMBL6535112 | 0.90 | ALDH1A1 (0.50) | ALDH1A1KDM4ELMNAASAH1POLB | |
| Fenipentol SCHEMBL27583052 | 0.87 | KDM4E (0.58) | ALDH1A1KDM4ELMNAASAH1POLB | |
| Fenipentol SCHEMBL27504649 | 0.86 | LMNA (0.57) | ALDH1A1KDM4ELMNAASAH1POLB | |
| SCHEMBL28218362 | 0.86 | LMNA (0.61) | ALDH1A1KDM4ELMNAASAH1RIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4650898-A | PERFUMES, FOODS, CHEWING GUMS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1987-03-17 | — | — | US | disclosed |
| US-4632831-A | GRAFEFRUIT-LIKE | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1986-12-30 | — | — | US | disclosed |
| US-4610812-A | Uses of methyl phenyl pentanol derivatives in augmenting or enhancing the aroma or taste of consumable materials | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1986-09-09 | — | — | US | disclosed |