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.
Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | PRKCA | P17252 | 2/20 | 0.33 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6854226 | 0.97 | CA2 (0.37) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6291923 | 0.85 | PRKCA (0.43) | CA2CA1CA12CA7CA9 | |
| SCHEMBL4606941 | 0.84 | CA12 (0.53) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6854229 | 0.83 | LCK (0.44) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6291892 | 0.83 | LCK (0.44) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6293031 | 0.83 | PRKCA (0.45) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6856281 | 0.82 | PRKCA (0.43) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6295996 | 0.82 | ALDH1A1 (0.46) | KMT2APRKCAPRKCDTSHR | |
| SCHEMBL6296712 | 0.81 | CA12 (0.39) | CA2CA1CA12CA7CA9 | |
| SCHEMBL6296114 | 0.81 | ALDH1A1 (0.48) | KMT2APRKCAPRKCD |
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-6977129-B2 | Charge control agent, toner using same developer containing the toner and developing device containing the developer | RICOH COMPANY, LTD. (JP) | 2005-12-20 | — | — | US | disclosed |
| US-20030162018-A1 | Charge control agent, toner using same developer containing the toner and developing device containing the developer | TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) | 2003-08-28 | — | — | US | disclosed |