Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.44 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29227269 | 0.79 | IDO1 (0.38) | ABCG2MAOBALDH1A1CYP3A4MEN1 | |
| SCHEMBL30554743 | 0.76 | TP53 (0.39) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL29227372 | 0.76 | TP53 (0.39) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL29227273 | 0.74 | MGAM (0.35) | ABCG2MAOBALDH1A1CYP3A4MEN1 | |
| SCHEMBL29227267 | 0.69 | CYP1A2 (0.37) | ABCG2ABCB1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL18088203 | 0.68 | ACACA (0.41) | ABCB1MAOBMEN1KMT2AMAPT | |
| SCHEMBL4448303 | 0.67 | APP (0.61) | ABCG2MAOBALDH1A1CYP3A4MEN1 | |
| SCHEMBL16020432 | 0.67 | GSTP1 (0.48) | CYP1A2CYP3A4NPC1RAB9ACYP2C9 | |
| SCHEMBL29943243 | 0.67 | ENPP1 (0.39) | ABCB1MAOBMAPTSMN1; SMN2CA1 | |
| SCHEMBL16011199 | 0.66 | APP (0.55) | ABCG2MAOBALDH1A1CYP3A4EGFR |
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 |