Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G7 | Q13093 | 20/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 13/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 13/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL3106244 | 0.93 | PLA2G7 (0.72) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL5867348 | 0.93 | PLA2G7 (0.71) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| Cadaverine Tartrate SCHEMBL5867463 | 0.90 | PLA2G7 (0.67) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| Citric Acid SCHEMBL5867324 | 0.88 | PLA2G7 (0.65) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| SCHEMBL4415312 | 0.87 | PLA2G7 (0.64) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| SCHEMBL4414086 | 0.87 | PLA2G7 (0.64) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL4417218 | 0.87 | PLA2G7 (0.63) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL5867351 | 0.87 | PLA2G7 (0.63) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 | |
| SCHEMBL5867421 | 0.87 | PLA2G7 (0.66) | PLA2G7CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL5867425 | 0.86 | PLA2G7 (0.64) | PLA2G7CYP3A4CYP2D6CYP1A2CYP2C9 |
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-7115616-B2 | Pyrimidinone compounds | SMITHKLINE BEECHAM PLC (GB) | 2006-10-03 | — | — | US | disclosed |
| EP-1479671-A1 | Pyrimidinone compounds | SMITHKLINE BEECHAM PLC (GB) | 2004-11-24 | — | — | EP | disclosed |