Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | STAT1 | P42224 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2424187 | 0.78 | MAOA (0.43) | MAOAALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL2425524 | 0.78 | MAOB (0.53) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL3661536 | 0.71 | NPC1 (0.83) | NPC1RAB9AMAOAALDH1A1KDM4E | |
| SCHEMBL2427801 | 0.70 | ALDH1A1 (0.52) | NPC1RAB9AMAOAALDH1A1KDM4E | |
| SCHEMBL28473332 | 0.69 | KDM1A (0.33) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL2422357 | 0.68 | POLB (0.36) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL7331388 | 0.66 | KDM4E (0.86) | NPC1RAB9AMAOAALDH1A1KDM4E | |
| SCHEMBL7234801 | 0.66 | MAOA (0.64) | NPC1RAB9AMAOAALDH1A1KDM4E | |
| SCHEMBL16697876 | 0.66 | KDM4E (0.68) | NPC1RAB9AMAOAALDH1A1KDM4E | |
| SCHEMBL9636407 | 0.66 | KDM4E (0.64) | NPC1RAB9AMAOAALDH1A1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2368895-A1 | Ferrocenyl flavonoids | Centre National de la Recherche Scientifique (CNRS) (FR) | 2011-09-28 | — | — | EP | disclosed |