Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | FADS1 | O60427 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7913356 | 1.00 | HPGD (0.59) | HPGDNPSR1PGRFADS1MEN1 | |
| SCHEMBL2150085 | 0.92 | HPGD (0.58) | HPGDNPSR1PGRFADS1MEN1 | |
| SCHEMBL4544831 | 0.88 | APP (0.62) | HPGDFADS1MEN1KMT2AAPP | |
| SCHEMBL1685626 | 0.85 | HPGD (0.73) | HPGDNPSR1MEN1KMT2AAPP | |
| SCHEMBL1686631 | 0.85 | FADS1 (0.59) | FADS1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL12154879 | 0.84 | APP (0.58) | HPGDMEN1KMT2AAPPMAPT | |
| SCHEMBL3951892 | 0.83 | MEN1 (0.68) | HPGDNPSR1FADS1MEN1KMT2A | |
| SCHEMBL30342506 | 0.83 | MEN1 (0.68) | HPGDNPSR1FADS1MEN1KMT2A | |
| SCHEMBL6351957 | 0.82 | PKM (0.55) | FADS1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL9480224 | 0.82 | HPGD (0.49) | HPGDNPSR1PGRFADS1MEN1 |
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-113999120-B | Preparation method of halogenated aniline compound | 郑州原理生物科技有限公司 | 2024-02-27 | — | — | CN | disclosed |