Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29227372 | 1.00 | TP53 (0.39) | TP53SMN1; SMN2MAPTTHRBNPC1 | |
| SCHEMBL29227269 | 0.88 | IDO1 (0.38) | TP53SMN1; SMN2MAPTTHRBNPC1 | |
| SCHEMBL30307098 | 0.85 | NTRK1 (0.47) | TP53SMN1; SMN2MAPTNPC1MAPK1 | |
| SCHEMBL29227273 | 0.83 | MGAM (0.35) | TP53SMN1; SMN2MAPTTHRBNPC1 | |
| SCHEMBL30554740 | 0.76 | ABCG2 (0.44) | TP53SMN1; SMN2MAPTTHRBNPC1 | |
| SCHEMBL16020432 | 0.75 | GSTP1 (0.48) | NPC1RAB9A | |
| SCHEMBL29227267 | 0.75 | CYP1A2 (0.37) | SMN1; SMN2MAPTNPC1NTRK1NTRK2 | |
| SCHEMBL29227271 | 0.73 | ABCG2 (0.39) | SMN1; SMN2MAPTNPC1NTRK1NTRK2 | |
| SCHEMBL29943243 | 0.72 | ENPP1 (0.39) | TP53SMN1; SMN2MAPTTHRB | |
| SCHEMBL29227266 | 0.71 | ALDH1A1 (0.36) | MAPTMEN1KMT2AESR2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116535293-A | Y-type bromopyrene intermediate and derivative, preparation method and application thereof | 广东工业大学 | 2023-08-04 | — | — | CN | disclosed |