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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CES1 | P23141 | 6/20 | 0.42 |
| ▸ | CES2 | O00748 | 5/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4303061 | 1.00 | CA1 (0.42) | CA1CES1CES2CA2FDPS | |
| SCHEMBL31150307 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| SCHEMBL28648937 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| SCHEMBL22396505 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| SCHEMBL6521283 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| Potassium Ion SCHEMBL25232930 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| SCHEMBL8703473 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| SCHEMBL8703475 | 0.98 | CA1 (0.41) | CA1CES1CES2CA2FDPS | |
| SCHEMBL22396447 | 0.91 | CES2 (0.42) | CA1CES1CES2CA2FDPS | |
| SCHEMBL22396481 | 0.89 | CES2 (0.44) | CES1CES2CA2FDPS |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7547431-B2 | High purity nanoscale metal oxide powders and methods to produce such powders | PPG INDUSTRIES OHIO, INC. (US) | 2009-06-16 | — | — | US | disclosed |
| EP-1318169-B1 | Stabilized halogen-containing polymer composition | ROHM & HAAS (US) | 2006-06-14 | — | — | EP | disclosed |
| US-7029507-B2 | Polishing using multi-metal oxide nanopowders | NANOPRODUCTS CORPORATION (US) | 2006-04-18 | — | — | US | disclosed |
| US-6897254-B2 | Stabilized halogen-containing polymer composition | ROHM AND HAAS COMPANY (US) | 2005-05-24 | — | — | US | disclosed |
| US-20050063889-A9 | High purity nanoscale metal oxide powders and methods to produce such powders | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2005-03-24 | — | — | US | disclosed |
| US-6786950-B2 | PROCESSING PRECURSOR AT A TEMPERATURE GREATER THAN 2000 DEGREES C IN A GAS COMPRISING OXYGEN AND TRANSFORMING PRECURSOR TO FINE METAL POWDER | NANOPRODUCTS CORPORATION | 2004-09-07 | — | — | US | disclosed |
| US-20030158311-A1 | Stabilized halogen-containing polymer composition | PMC CINCINNATI, INC. | 2003-08-21 | — | — | US | disclosed |
| EP-1318169-A2 | Stabilized halogen-containing polymer composition | ROHM AND HAAS COMPANY (US) | 2003-06-11 | — | — | EP | disclosed |
| US-6569397-B1 | Nanoscale powder with purity greater than 99.9% by metal basis and comprising silicon carbide; pure precursor processed at high temperature | Yadav, Tapesh | 2003-05-27 | — | — | US | disclosed |