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 | |
|---|---|---|---|---|
| SCHEMBL8648193 | 0.88 | — | — | |
| SCHEMBL4808121 | 0.88 | — | — | |
| Lithium Ion SCHEMBL21383107 | 0.88 | — | — | |
| Potassium Ion SCHEMBL251327 | 0.88 | — | — | |
| SCHEMBL147778 | 0.88 | — | — | |
| SCHEMBL4810878 | 0.88 | — | — | |
| Tetramethylammonium Ion SCHEMBL4809972 | 0.81 | — | — | |
| SCHEMBL14855405 | 0.76 | — | — | |
| SCHEMBL20599260 | 0.74 | — | — | |
| SCHEMBL149311 | 0.73 | — | — |
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-6929865-B2 | Steel reinforced concrete systems | MYRICK JAMES J (US) | 2005-08-16 | — | — | US | disclosed |
| US-20020177003-A1 | Steel reinforced concrete systems | MYRICK JAMES J (US) | 2002-11-28 | — | — | US | disclosed |