Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 6/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30554741 | 1.00 | ABCG2 (0.39) | ABCG2MAOBHDAC4HDAC2HDAC8 | |
| SCHEMBL30554744 | 0.81 | NTRK1 (0.38) | ABCG2MAOBHDAC4HDAC2HDAC8 | |
| SCHEMBL29227272 | 0.81 | NTRK1 (0.38) | ABCG2MAOBHDAC4HDAC2HDAC8 | |
| SCHEMBL29227267 | 0.79 | CYP1A2 (0.37) | ABCG2MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL29227269 | 0.79 | IDO1 (0.38) | ABCG2MAOBHDAC4HDAC2HDAC8 | |
| SCHEMBL30307098 | 0.79 | NTRK1 (0.47) | ABCG2HDAC4HDAC2HDAC8MEN1 | |
| SCHEMBL25226274 | 0.77 | ESR2 (0.52) | MAOBHDAC4HDAC2HDAC8MEN1 | |
| SCHEMBL28696774 | 0.76 | ABCG2 (0.43) | ABCG2MAOBHDAC4HDAC2HDAC8 | |
| SCHEMBL6579959 | 0.75 | ABCG2 (0.41) | ABCG2MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL160600 | 0.74 | ENPP1 (0.39) | ABCG2MEN1KMT2AALDH1A1MAPT |
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 |