Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 9/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.38 |
| ▸ | RELA | Q04206 | 3/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3763187 | 0.88 | MAPT (0.49) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3455783 | 0.86 | TP53 (0.43) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10179530 | 0.86 | TP53 (0.54) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3760776 | 0.86 | CA9 (0.47) | TP53S1PR1 | |
| SCHEMBL10181578 | 0.85 | MAPT (0.53) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10179953 | 0.85 | RAB9A (0.47) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10181814 | 0.84 | TP53 (0.42) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL27829115 | 0.84 | TP53 (0.45) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL3766252 | 0.83 | TP53 (0.42) | TP53MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10182852 | 0.82 | TP53 (0.42) | TP53MAPTSMN1; SMN2NPC1RAB9A |
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 |