Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.48 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.48 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL571346 | 0.82 | SIRT2 (0.60) | ALDH1A1HSD17B10KDM4EHPGDTHRB | |
| SCHEMBL1233667 | 0.81 | MAPT (0.53) | ALDH1A1HSD17B10USP2THRBRAB9A | |
| SCHEMBL25328235 | 0.80 | THRB (0.77) | ALDH1A1HSD17B10USP2THRBRAB9A | |
| SCHEMBL7129338 | 0.79 | KDM4E (0.63) | ALDH1A1HSD17B10KDM4EHPGDRAB9A | |
| SCHEMBL1235984 | 0.78 | F7 (0.54) | ALDH1A1HSD17B10USP2THRBRAB9A | |
| SCHEMBL17490812 | 0.76 | ALDH1A1 (0.75) | ALDH1A1HSD17B10KDM4EHPGDRAB9A | |
| SCHEMBL31204910 | 0.76 | ALDH1A1 (0.58) | ALDH1A1HSD17B10KDM4EHPGDUSP2 | |
| SCHEMBL3714863 | 0.76 | ALDH1A1 (0.58) | ALDH1A1HSD17B10KDM4EHPGDUSP2 | |
| SCHEMBL8351026 | 0.75 | ALDH1A1 (0.69) | ALDH1A1HSD17B10KDM4EHPGDRAB9A | |
| SCHEMBL10725418 | 0.74 | THRB (0.64) | ALDH1A1HSD17B10USP2THRBRAB9A |
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-2285376-A1 | 6-AMINONICOTINAMIDE DERIVATIVES AS POTENT AND SELECTIVE HISTONE DEACETYLASE INHIBITORS | Chipscreen Biosciences Ltd. (CN) | 2011-02-23 | — | — | EP | disclosed |