Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ATM | Q13315 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30709668 | 0.81 | CA2 (0.53) | HSPA5ALDH1A1TSHRMAPTLMNA | |
| SCHEMBL30709713 | 0.80 | TSHR (0.50) | ALDH1A1TSHRMAPTLMNAGAA | |
| SCHEMBL9136246 | 0.80 | TSHR (0.50) | ALDH1A1TSHRMAPTLMNAGAA | |
| SCHEMBL30709677 | 0.77 | CA2 (0.58) | ALDH1A1TSHRMAPTLMNAGAA | |
| SCHEMBL10512771 | 0.76 | HSPA5 (0.56) | HSPA5ALDH1A1TSHRMAPTLMNA | |
| SCHEMBL30641457 | 0.75 | ALDH1A1 (0.51) | ALDH1A1TSHRMAPTLMNAGAA | |
| SCHEMBL39434 | 0.74 | HSPA5 (0.74) | HSPA5ALDH1A1TSHRMAPTLMNA | |
| SCHEMBL18982775 | 0.72 | CA2 (0.50) | HSPA5ALDH1A1TSHRMAPTLMNA | |
| SCHEMBL6899388 | 0.71 | TP53 (0.54) | ALDH1A1TSHRLMNAKDM4ECA2 | |
| Hydrochloric Acid SCHEMBL6039741 | 0.71 | HSPA5 (0.69) | HSPA5ALDH1A1TSHRMAPTLMNA |
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-116903773-A | Preparation method of polymer composite copper catalytic material and application of polymer composite copper catalytic material in synthesis of chiral gem diaryl borate | 湖北工程学院 | 2023-10-20 | — | — | CN | disclosed |