Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 0.53 |
| ▸ | RAB9A | P51151 | 9/20 | 0.53 |
| ▸ | NPC1 | O15118 | 9/20 | 0.53 |
| ▸ | TP53 | P04637 | 8/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL493675 | 0.76 | ALDH1A1 (0.64) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL1250902 | 0.70 | SMN1; SMN2 (0.67) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL20405758 | 0.69 | LMNA (0.39) | RAB9ANPC1TP53L3MBTL1GAA | |
| SCHEMBL493192 | 0.68 | NPC1 (0.56) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL23288078 | 0.68 | CASP3 (0.71) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL3667161 | 0.68 | ALDH1A1 (0.59) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL16975847 | 0.66 | SMN1; SMN2 (0.61) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL6979588 | 0.66 | RAB9A (0.61) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL27584128 | 0.66 | SMN1; SMN2 (0.80) | SMN1; SMN2RAB9ANPC1TP53ALDH1A1 | |
| SCHEMBL20405837 | 0.65 | S1PR1 (0.40) | SMN1; SMN2NPC1TP53ALDH1A1MEN1 |
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-2250165-B1 | TRIAZOLE OXADIAZOLES DERIVATIVES | MERCK SERONO SA (CH) | 2018-07-25 | — | — | EP | disclosed |