Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL3477071 | 0.71 | L3MBTL1 (0.43) | MEN1KMT2AALDH1A1RAB9ANPC1 | |
| SCHEMBL19466587 | 0.71 | UCHL1 (0.55) | KMT2AUSP2ALDH1A1NPC1KDM4E | |
| SCHEMBL338850 | 0.70 | KDM4E (0.33) | KDM4E | |
| SCHEMBL16832321 | 0.69 | GAA (0.69) | PTGDR2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29050427 | 0.69 | ALDH1A1 (0.50) | PTGDR2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19466559 | 0.69 | SMN1; SMN2 (0.40) | USP2SMN1; SMN2ALDH1A1KDM4EMAPT | |
| SCHEMBL17777762 | 0.69 | KDM4E (0.41) | PTGDR2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL366006 | 0.68 | CA1 (0.52) | MAPK1TDP1 | |
| SCHEMBL16969082 | 0.68 | IDO1 (0.39) | CYP3A4KMT2ASMN1; SMN2ALDH1A1ALOX15 | |
| SCHEMBL16855655 | 0.67 | RAB9A (0.58) | PTGDR2CYP1A2CYP3A4CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010070076-A1 | ALKANOIC ACID DERIVATIVES AND THEIR THERAPEUTIC USE AS HDAC INHIBITORS | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2010-06-24 | — | — | WO | disclosed |