Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Triallate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| Triallate SCHEMBL10795895 | 0.98 | — | — | |
| Triallate SCHEMBL3787679 | 0.93 | — | — | |
| Triallate SCHEMBL8537965 | 0.93 | — | — | |
| Triallate SCHEMBL20636814 | 0.91 | SMN1; SMN2 (0.31) | — | |
| Triallate SCHEMBL17110498 | 0.91 | — | — | |
| Triallate SCHEMBL909879 | 0.91 | — | — | |
| Triallate SCHEMBL3089362 | 0.91 | — | — | |
| Triallate SCHEMBL973423 | 0.91 | — | — | |
| Triallate SCHEMBL17700977 | 0.89 | — | — | |
| Triallate SCHEMBL11670923 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4439555-A | DITHIOCARBAMATES OR THIURAM SULFIDES, TIN COMPOUND | NIPPON OIL AND FATS CO., LTD. (JP) | 1984-03-27 | — | — | US | disclosed |