Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Nerol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.91 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.91 |
| ▸ | MEN1 | O00255 | 2/20 | 0.91 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.91 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.86 |
| ▸ | MAPT | P10636 | 2/20 | 0.86 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.86 |
| ▸ | SQLE | Q14534 | 7/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ICMT | O60725 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Geraniol SCHEMBL668456 | 1.00 | KMT2A (0.91) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Geraniol SCHEMBL1665820 | 1.00 | KMT2A (0.91) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Geraniol SCHEMBL8124286 | 1.00 | KMT2A (0.91) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Solanesol SCHEMBL6317060 | 0.98 | KMT2A (0.91) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Farnesol SCHEMBL11215938 | 0.98 | KMT2A (0.91) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Farnesol SCHEMBL1549561 | 0.98 | KMT2A (0.91) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Geraniol SCHEMBL2874022 | 0.95 | KMT2A (1.00) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Geraniol SCHEMBL21173796 | 0.95 | KMT2A (1.00) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Geraniol SCHEMBL8676054 | 0.95 | KMT2A (1.00) | KMT2AALOX15MEN1CYP3A4ALDH1A1 | |
| Geraniol SCHEMBL19824 | 0.95 | KMT2A (1.00) | KMT2AALOX15MEN1CYP3A4ALDH1A1 |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113215131-B | Phosphate hydrolase and application thereof | 天津大学佐治亚理工深圳学院 | 2023-06-20 | — | — | CN | claimed |
| CN-113215131-A | Phosphohydrolase and application thereof | 天津大学佐治亚理工深圳学院 | 2021-08-06 | — | — | CN | claimed |
| JP-54076506-A | — | — | None | — | — | JP | disclosed |
| CN-113215131-B | Phosphate hydrolase and application thereof | 天津大学佐治亚理工深圳学院 | 2023-06-20 | — | — | CN | disclosed |
| CN-113215131-B | Phosphate hydrolase and application thereof | 天津大学佐治亚理工深圳学院 | 2023-06-20 | — | — | CN | disclosed |
| US-11324209-B2 | Composition to promote migration of acarids | ACAR'UP SPRL (BE) | 2022-05-10 | — | — | US | disclosed |
| CN-113215131-A | Phosphohydrolase and application thereof | 天津大学佐治亚理工深圳学院 | 2021-08-06 | — | — | CN | disclosed |
| CN-113215131-A | Phosphohydrolase and application thereof | 天津大学佐治亚理工深圳学院 | 2021-08-06 | — | — | CN | disclosed |
| US-20200390077-A1 | Composition to Promote Migration of Acarids | ACAR'UP SPRL (BE) | 2020-12-17 | — | — | US | disclosed |
| EP-3716770-A1 | KIT AND METHOD USING A SYNERGISTIC COMPOSITION TO ATTRACT AND REMOVE ACARIDS | Acar'Up sprl (BE) | 2020-10-07 | — | — | EP | disclosed |
| EP-3716769-A1 | COMPOSITION TO PROMOTE MIGRATION OF ACARIDS | Acar'Up sprl (BE) | 2020-10-07 | — | — | EP | disclosed |
| US-7166728-B2 | Process for preparation of nerol oxide | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2007-01-23 | — | — | US | disclosed |
| US-7166728-B2 | Process for preparation of nerol oxide | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2007-01-23 | — | — | US | disclosed |
| WO-2006070383-A1 | PROCESS FOR THE PREPARATION OF NEROL OXIDE | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-07-06 | — | — | WO | disclosed |
| WO-2006070383-A1 | PROCESS FOR THE PREPARATION OF NEROL OXIDE | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-07-06 | — | — | WO | disclosed |
| US-20060142450-A1 | By haloalkoxylating nerol to produce a 7-alkoxy-3,7-dimethyl-6-halo-2-octenol, dehydrohalogenating the product to produce a 7-alkoxy-3,7-dimethyl-octa-2,5-dien-1-ol, which is cyclized, especially using dilute mineral acid, lewis acid or an acidic resin to produce racemic nerol oxide | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-06-29 | — | — | US | disclosed |
| US-20060142450-A1 | By haloalkoxylating nerol to produce a 7-alkoxy-3,7-dimethyl-6-halo-2-octenol, dehydrohalogenating the product to produce a 7-alkoxy-3,7-dimethyl-octa-2,5-dien-1-ol, which is cyclized, especially using dilute mineral acid, lewis acid or an acidic resin to produce racemic nerol oxide | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2006-06-29 | — | — | US | disclosed |
| JP-S5476506-A | PREPARATION OF GERANIOL | NISSAN CHEM IND LTD | 1979-06-19 | — | — | JP | disclosed |