Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TYMS | P04818 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3535548 | 0.85 | ALDH1A1 (0.47) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23777759 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL30208087 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23784821 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23777638 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11270921 | 0.78 | ALDH1A1 (0.59) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL14346586 | 0.78 | MAPT (0.56) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3071195 | 0.77 | KDM4E (0.55) | ALDH1A1TSHRCYP1A2HSD17B10CYP3A4 | |
| SCHEMBL30299431 | 0.77 | KDM4E (0.55) | ALDH1A1TSHRCYP1A2HSD17B10CYP3A4 | |
| SCHEMBL9851153 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 |
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-111808003-A | Preparation method of thioether | 甘肃农业大学 | 2020-10-23 | — | — | CN | disclosed |