Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 1.00 |
| ▸ | MAPT | P10636 | 9/20 | 0.74 |
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | CASP3 | P42574 | 1/20 | 0.62 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.62 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.62 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 5/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.59 |
| ▸ | F3 | P13726 | 2/20 | 0.56 |
| ▸ | MAOA | P21397 | 2/20 | 0.56 |
| ▸ | MAOB | P27338 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL17429547 | 1.00 | ABCG2 (1.00) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL11477087 | 0.87 | ABCG2 (0.77) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL11477089 | 0.87 | ABCG2 (0.77) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL8078718 | 0.86 | ABCG2 (0.76) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL8663226 | 0.86 | ABCG2 (0.76) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL3035768 | 0.85 | ABCG2 (0.74) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL7203615 | 0.85 | MAPT (1.00) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL7203616 | 0.85 | MAPT (1.00) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL3035766 | 0.85 | ABCG2 (0.74) | ABCG2MAPTNPC1RAB9ACASP3 | |
| SCHEMBL31301136 | 0.85 | ABCG2 (0.74) | ABCG2MAPTNPC1RAB9ACASP3 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116217461-B | Chalcone derivative containing indole structure and preparation method and application thereof | 贵州大学 | 2024-10-18 | — | — | CN | disclosed |
| CN-116283789-B | Pyridazine-containing chalcone derivative and preparation method and application thereof | 贵州大学 | 2024-09-03 | — | — | CN | disclosed |
| CN-116283789-A | Pyridazine-containing chalcone derivative and preparation method and application thereof | 贵州大学 | 2023-06-23 | — | — | CN | disclosed |
| CN-116217461-A | Chalcone derivative containing indole structure and preparation method and application thereof | 贵州大学 | 2023-06-06 | — | — | CN | disclosed |
| CN-114085199-B | Chalcone derivative containing sulfonyl piperazine as well as preparation method and application thereof | 贵州大学 | 2023-04-21 | — | — | CN | disclosed |
| CN-109293616-B | Coumarin-containing chalcone derivatives, and preparation method and application thereof | 贵州大学 | 2022-06-21 | — | — | CN | disclosed |
| CN-109810068-B | Chalcone derivative containing thioether triazole, preparation method and application | 贵州大学 | 2022-03-18 | — | — | CN | disclosed |
| CN-114085199-A | Chalcone derivative containing sulfonyl piperazine and preparation method and application thereof | 贵州大学 | 2022-02-25 | — | — | CN | disclosed |