Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6403551 | 0.88 | ALDH1A1 (0.64) | ALDH1A1HTTHSD17B10ALOX15MAPK1 | |
| SCHEMBL20514144 | 0.82 | MAPK1 (0.55) | ALDH1A1HTTHSD17B10ALOX15MAPK1 | |
| SCHEMBL5328529 | 0.81 | MEN1 (0.70) | ALDH1A1HTTHSD17B10ALOX15MAPK1 | |
| SCHEMBL5334182 | 0.76 | PKM (0.89) | ALDH1A1HTTHSD17B10CYP3A4CYP2C19 | |
| SCHEMBL5333083 | 0.76 | MAPT (0.68) | ALDH1A1HSD17B10ALOX15MAPK1CYP3A4 | |
| SCHEMBL5332243 | 0.75 | ALDH1A1 (0.67) | ALDH1A1HSD17B10MAPK1MEN1KMT2A | |
| SCHEMBL14478938 | 0.74 | ALDH1A1 (0.66) | ALDH1A1HSD17B10MAPK1CYP3A4CYP2C19 | |
| SCHEMBL5331484 | 0.74 | ALDH1A1 (0.66) | ALDH1A1HSD17B10MAPK1CYP3A4CYP2C19 | |
| SCHEMBL6404421 | 0.74 | MAPK1 (0.65) | ALDH1A1HTTHSD17B10ALOX15MAPK1 | |
| SCHEMBL6408488 | 0.73 | ALDH1A1 (0.70) | ALDH1A1HSD17B10MEN1KMT2ALMNA |
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-2007047394-A2 | THIOTRIAZOLYL DERIVATIVES | EPIX DELAWARE, INC. (US) | 2007-04-26 | — | — | WO | disclosed |