Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Ether SCHEMBL7106216 | 0.90 | — | — | |
| Ether SCHEMBL17291816 | 0.90 | — | — | |
| Ether SCHEMBL626639 | 0.90 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL11647687 | 0.90 | — | — | |
| Ether SCHEMBL9788714 | 0.90 | — | — | |
| Ether SCHEMBL10629462 | 0.90 | — | — | |
| Ether SCHEMBL355376 | 0.90 | — | — | |
| Ether SCHEMBL10501726 | 0.90 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL18173787 | 0.90 | ALDH1A1 (0.41) | — | |
| Ether SCHEMBL7632694 | 0.90 | — | — |
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-1024665-C | process for preparing ring-substituted 2-amino-1, 2, 3, 4-tetrahydronaphthalenes | LILLY CO ELI (US) | 1994-05-25 | — | — | CN | disclosed |
| US-5034489-A | Crosslinkable silicone polymers for molding materials, waterprofing agents and textiles | GENERAL ELECTRIC COMPANY (US) | 1991-07-23 | — | — | US | disclosed |
| EP-0427100-A2 | Silicone copolymers having tetraorganodisiloxy groups and intermediates thereof | GENERAL ELECTRIC COMPANY (US) | 1991-05-15 | — | — | EP | disclosed |
| CN-1038644-A | Nuclear substituted 2-amino-1,2,3,4-tetralin class | LILLY CO ELI (US) | 1990-01-10 | — | — | CN | disclosed |