Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | TSPO | P30536 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8976154 | 0.79 | MAPT (0.33) | ACHEMAPTHTTHSP90AA1BCHE | |
| SCHEMBL1921514 | 0.75 | MAPT (0.46) | ACHEMAPTHTTBCHEEGFR | |
| SCHEMBL1923381 | 0.74 | GPR3 (0.64) | ACHEMAPTHTTBCHEEGFR | |
| Trifluoromethanesulfonic Acid SCHEMBL8975675 | 0.73 | ACHE (0.37) | ACHEMAPTHTTHSP90AA1BCHE | |
| SCHEMBL9979912 | 0.72 | MAPT (0.43) | ACHEMAPTHTTBCHEEGFR | |
| SCHEMBL12418696 | 0.71 | GPR3 (0.59) | ACHEMAPTHTTBCHEEGFR | |
| SCHEMBL12395962 | 0.70 | HSP90AA1 (0.31) | MAPTHTTHSP90AA1KDM4E | |
| SCHEMBL20368211 | 0.69 | ACHE (0.41) | ACHEMAPTHTTBCHEEGFR | |
| SCHEMBL15820932 | 0.69 | ALKBH5 (0.43) | ACHEMAPTHTTBCHEEGFR | |
| Carbazole SCHEMBL9423253 | 0.69 | GPR3 (0.50) | ACHEMAPTHTTBCHETSPO |
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 |
|---|---|---|---|---|---|---|---|
| US-5532261-A | TREATING STAPHYLOCOCCUS INFECTIONS | MERCK & CO., INC. (US) | 1996-07-02 | — | — | US | disclosed |