Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 7/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.58 |
| ▸ | BCHE | P06276 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.58 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.58 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Chalcone SCHEMBL28847698 | 0.88 | CYP1B1 (0.63) | MAOBCYP1B1BCHEMAPTTNFRSF1A | |
| Chalcone SCHEMBL28873552 | 0.82 | CYP1B1 (0.63) | MAOBCYP1B1BCHEMAPTTNFRSF1A | |
| SCHEMBL31611909 | 0.78 | MAPT (0.50) | MAOBCYP1B1BCHEMAPTTNFRSF1A | |
| Chalcone SCHEMBL27913991 | 0.78 | CYP1B1 (0.88) | MAOBCYP1B1BCHEMAPTTNFRSF1A | |
| SCHEMBL39718 | 0.78 | ALDH1A1 (0.50) | CYP1B1MAPTLMNAACHECYP3A4 | |
| SCHEMBL29392367 | 0.78 | ALDH1A1 (0.50) | CYP1B1MAPTLMNAACHECYP3A4 | |
| Methyl Alcohol SCHEMBL27597852 | 0.76 | ALDH1A1 (0.46) | MAPTLMNAKMT2AMEN1PKM | |
| SCHEMBL31340003 | 0.76 | ALDH1A1 (0.49) | CYP1B1MAPTLMNAACHECYP3A4 | |
| SCHEMBL548710 | 0.76 | ALDH1A1 (0.49) | CYP1B1MAPTLMNAACHECYP3A4 | |
| SCHEMBL548781 | 0.76 | ALDH1A1 (0.49) | CYP1B1MAPTLMNAACHECYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109810068-B | Chalcone derivative containing thioether triazole, preparation method and application | 贵州大学 | 2022-03-18 | — | — | CN | disclosed |
| CN-109810068-A | A kind of chalcone derivative, the Preparation method and use of Sulfide-containing Hindered triazole | 贵州大学 | 2019-05-28 | — | — | CN | disclosed |