Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.52 |
| ▸ | RAB9A | P51151 | 7/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 10/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | TOP2A | P11388 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5844099 | 0.90 | MAOA (0.52) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL5843269 | 0.86 | KDM4E (0.53) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL12228491 | 0.82 | CYP19A1 (0.60) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL29440787 | 0.81 | AKR1C3 (0.54) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL61277 | 0.81 | AKR1C3 (0.54) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL29440785 | 0.81 | AKR1C3 (0.54) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL6469733 | 0.81 | MAOA (0.49) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL8037820 | 0.79 | MAPT (0.55) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL7795159 | 0.79 | MAOB (0.58) | NPC1RAB9AMAOAMAPTKDM4E | |
| SCHEMBL7127255 | 0.77 | KDM4E (0.73) | NPC1RAB9AMAPTKDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050235428-A1 | Use of metal complex compounds as oxidation catalysts | CIBA SPECIALTY CHEMICALS CORP. | 2005-10-27 | — | — | US | disclosed |
| EP-1456216-A1 | USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS | Ciba SC Holding AG (CH) | 2004-09-15 | — | — | EP | disclosed |
| WO-2003053986-A1 | USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2003-07-03 | — | — | WO | disclosed |