Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Myrtenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CXCR3 | P49682 | 14/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Myrtenol SCHEMBL5606221 | 1.00 | TSHR (0.51) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL24281940 | 0.92 | TSHR (0.58) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL155709 | 0.92 | TSHR (0.58) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL3836506 | 0.92 | TSHR (0.58) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL14763830 | 0.92 | TSHR (0.58) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL15536292 | 0.92 | TSHR (0.58) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL15442802 | 0.87 | TSHR (0.54) | TSHRKDM4EHTTTDP1CXCR3 | |
| Myrtenol SCHEMBL5606226 | 0.86 | TDP1 (0.45) | TSHRKDM4EHTTTDP1CXCR3 | |
| Acetic Acid SCHEMBL14764134 | 0.82 | KDM4E (0.47) | TSHRKDM4EHTTTDP1CXCR3 | |
| Acetic Acid SCHEMBL30496778 | 0.81 | TSHR (0.46) | TSHRKDM4EHTTTDP1CXCR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118169281-A | Method for detecting content of myrtenyl acetate in valerian essential oil | 多特瑞(上海)生物科技有限公司 | 2024-06-11 | — | — | CN | disclosed |
| US-20090031455-A1 | TERPENE HYDROXYLATION | PLANT RESEARCH INTERNATIONAL B.V. (NL) | 2009-01-29 | — | — | US | disclosed |
| EP-1805311-A2 | TERPENE HYDROXYLATION | Plant Research International B.V. (NL) | 2007-07-11 | — | — | EP | disclosed |
| WO-2006065126-A2 | TERPENE HYDROXYLATION | PLANT RESEARCH INTERNATIONAL B.V. (NL) | 2006-06-22 | — | — | WO | disclosed |