Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | GBA1 | P04062 | 5/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19903051 | 0.85 | HSD17B10 (0.43) | HSD17B10ALDH1A1KDM4ECYP1A2CYP2C9 | |
| SCHEMBL19893943 | 0.77 | HSD17B10 (0.42) | HSD17B10ALDH1A1KDM4ECYP1A2CYP2C9 | |
| SCHEMBL19903044 | 0.75 | GBA1 (0.53) | GBA1HCRTR1HCRTR2 | |
| SCHEMBL9513674 | 0.74 | KDM4E (0.59) | ALDH1A1KDM4EGBA1L3MBTL1SLC6A7 | |
| SCHEMBL19893926 | 0.74 | HCRTR1 (0.44) | HCRTR1HCRTR2 | |
| SCHEMBL19894074 | 0.74 | HCRTR1 (0.46) | HSD17B10ALDH1A1KDM4ECYP1A2CYP2C9 | |
| SCHEMBL19894090 | 0.73 | HCRTR1 (0.45) | HSD17B10PROKR1HCRTR1HCRTR2 | |
| SCHEMBL24799135 | 0.71 | SORD (0.48) | HSD17B10ALDH1A1CYP1A2CYP2C19GBA1 | |
| SCHEMBL9514848 | 0.71 | ALDH1A1 (0.64) | ALDH1A1KDM4ESMN1; SMN2MEN1MAPT | |
| SCHEMBL14276896 | 0.70 | MAP4K4 (0.51) | HSD17B10ALDH1A1GBA1L3MBTL1HPGD |
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-3287454-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2020-09-02 | — | — | EP | disclosed |