Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.49 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28408732 | 0.88 | HDAC1 (0.59) | HDAC1RECQLMEN1KMT2AHDAC3 | |
| SCHEMBL28408707 | 0.88 | HDAC1 (0.59) | HDAC1RECQLMEN1KMT2A | |
| SCHEMBL30368036 | 0.85 | HDAC1 (0.61) | HDAC1MEN1KMT2ALMNAEPHX2 | |
| SCHEMBL28411643 | 0.85 | ALDH1A1 (0.51) | HDAC1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL28416637 | 0.85 | HDAC1 (0.61) | HDAC1MEN1KMT2ALMNAEPHX2 | |
| SCHEMBL30368350 | 0.85 | ALDH1A1 (0.51) | HDAC1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL28891336 | 0.85 | HDAC1 (0.61) | HDAC1RECQLCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL22169186 | 0.83 | CYP1A2 (0.65) | HDAC1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28044791 | 0.83 | HIF1A (0.59) | RECQLCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28414956 | 0.82 | NPC1 (0.55) | MEN1KMT2ALMNAL3MBTL1 |
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-111303054-B | 3-acylamino-1, 3-quinazoline-2-ketone compound and preparation method and application thereof | 湖南科技大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-111303054-A | 3-acylamino-1, 3-quinazoline-2-ketone compound and preparation method and application thereof | 湖南科技大学 | 2020-06-19 | — | — | CN | disclosed |