Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| Calcium Hypochloride SCHEMBL20269 | 0.89 | — | — | |
| SCHEMBL9064948 | 0.89 | MAPK1 (0.60) | — | |
| Hydrochloric Acid SCHEMBL820062 | 0.80 | — | — | |
| SCHEMBL3195381 | 0.80 | — | — | |
| Water SCHEMBL966054 | 0.80 | — | — | |
| SCHEMBL4551808 | 0.80 | — | — | |
| Lithium Ion SCHEMBL11211373 | 0.80 | — | — | |
| SCHEMBL3802559 | 0.80 | — | — | |
| SCHEMBL6525104 | 0.80 | — | — | |
| Water SCHEMBL11617084 | 0.80 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7923036-B2 | Halogen-containing sanitizing composition | PPG INDUSTRIES OHIO, INC. (US) | 2011-04-12 | — | — | US | disclosed |
| US-20100080857-A1 | HALOGEN-CONTAINING SANITIZING COMPOSITION | PPG INDUSTRIES OHIO, INC. (US) | 2010-04-01 | — | — | US | disclosed |