Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.68 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.56 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17045851 | 0.88 | HDAC1 (0.61) | CYP2C19HDAC8HDAC6HDAC2HDAC1 | |
| SCHEMBL28719260 | 0.86 | HDAC2 (0.70) | HDAC8HDAC6HDAC2HPGDUSP2 | |
| SCHEMBL9374229 | 0.84 | CYP2C19 (0.66) | CYP2C19HPGDALDH1A1USP2TP53 | |
| SCHEMBL23077935 | 0.81 | HDAC8 (0.57) | CYP2C19HDAC8HDAC6HDAC2HPGD | |
| SCHEMBL10955028 | 0.81 | CYP2C19 (0.67) | CYP2C19HPGDALDH1A1USP2TP53 | |
| SCHEMBL4046464 | 0.81 | CYP2C19 (0.62) | CYP2C19HPGDALDH1A1USP2TP53 | |
| SCHEMBL5479031 | 0.81 | HDAC2 (0.64) | HDAC8HDAC6HDAC2HDAC1HDAC3 | |
| SCHEMBL44801 | 0.81 | CYP2C19 (1.00) | CYP2C19HDAC8HDAC6HDAC2HPGD | |
| SCHEMBL17117429 | 0.80 | HPGD (0.84) | CYP2C19HDAC8HDAC6HDAC2HPGD | |
| SCHEMBL11260584 | 0.78 | CYP2C19 (0.72) | CYP2C19HPGDALDH1A1USP2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114247566-B | High-sulfur bauxite desulfurization and desilication flotation collecting agent and integrated flotation method | 中南大学 | 2023-03-21 | — | — | CN | disclosed |
| CN-112592305-B | Organic compound and preparation method and application thereof | 中南大学 | 2022-10-18 | — | — | CN | disclosed |
| CN-114247566-A | High-sulfur bauxite desulfurization and desilication flotation collecting agent and integrated flotation method | 中南大学 | 2022-03-29 | — | — | CN | disclosed |
| CN-112592305-A | Organic compound and preparation method and application thereof | 中南大学 | 2021-04-02 | — | — | CN | disclosed |