Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3135538 | 0.83 | CTSD (0.56) | CTSDCA1CA2CA9ALDH1A1 | |
| SCHEMBL3412935 | 0.83 | GAA (0.62) | CTSDCA1CA2CA9ALDH1A1 | |
| SCHEMBL239328 | 0.82 | CTSD (0.63) | CTSDCA1CA2CA9ALDH1A1 | |
| SCHEMBL30547074 | 0.82 | CTSD (0.63) | CTSDCA1CA2CA9ALDH1A1 | |
| SCHEMBL28918514 | 0.81 | CTSD (0.46) | CTSDALDH1A1GAAKMT2AHPGD | |
| SCHEMBL9541052 | 0.81 | ALDH1A1 (0.54) | ALDH1A1GAAHPGDLMNAL3MBTL1 | |
| SCHEMBL3828592 | 0.81 | KDM4E (0.50) | ALDH1A1GAAMAPTMEN1KMT2A | |
| Hydroxyamine SCHEMBL14300671 | 0.80 | CTSD (0.61) | CTSDCA1CA2CA9ALDH1A1 | |
| Hydrazine SCHEMBL14300720 | 0.80 | CTSD (0.61) | CTSDCA1CA2CA9ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6692325 | 0.80 | CTSD (0.61) | CTSDCA1CA2CA9ALDH1A1 |
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-110041226-B | Compound with AIE characteristics and preparation method and application thereof | 江苏萨瑞斯医疗科技有限公司 | 2022-05-31 | — | — | CN | disclosed |