Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Ether. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 8/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.39 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.39 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.39 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL3261104 | 0.89 | DNM1 (0.63) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Hexane SCHEMBL148822 | 0.89 | CES2 (0.48) | MEN1KMT2AALDH1A1TSHRCES2 | |
| Decylamine SCHEMBL3405270 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Acetic Acid SCHEMBL5487885 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Dodecylamine SCHEMBL167181 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Octadecylamine SCHEMBL11524045 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Heptane SCHEMBL15662959 | 0.86 | CES2 (0.52) | MEN1KMT2AALDH1A1TSHRCES2 | |
| Icosylamine SCHEMBL5495670 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Hexadecylamine SCHEMBL325395 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Octadecylamine SCHEMBL9784638 | 0.86 | DNM1 (0.68) | DNM1MEN1KMT2AALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108102640-A | Quantum dot, the composition including it or compound and include its electronic device | 三星电子株式会社 | 2018-06-01 | — | — | CN | disclosed |