Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Amitrole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| Amitrole SCHEMBL2898789 | 0.92 | MGMT (0.38) | MGMTGAA | |
| Amitrole SCHEMBL2892139 | 0.90 | — | — | |
| Amitrole SCHEMBL788110 | 0.77 | HSP90AA1 (0.33) | — | |
| Amitrole SCHEMBL44637 | 0.77 | — | — | |
| Trifluoroacetic Acid SCHEMBL508966 | 0.76 | HRH4 (0.37) | — | |
| Amitrole SCHEMBL31379743 | 0.75 | — | — | |
| Amitrole SCHEMBL10399233 | 0.75 | — | — | |
| Amitrole SCHEMBL11745846 | 0.74 | KDM4E (0.32) | — | |
| Amitrole SCHEMBL1172473 | 0.71 | RXFP1 (0.45) | — | |
| Amitrole SCHEMBL7401602 | 0.67 | CDK1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2259665-A1 | Solution for surface treatment | MEC COMPANY LTD. (JP) | 2010-12-08 | — | — | EP | disclosed |