Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 9/20 | 0.43 |
| ▸ | MAPT | P10636 | 8/20 | 0.43 |
| ▸ | HPGD | P15428 | 6/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | HTR3A | P46098 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9914231 | 0.81 | ACHE (0.58) | ACHEALDH1A1CYP3A4L3MBTL1MAPT | |
| SCHEMBL9018791 | 0.79 | MAPT (0.38) | ACHEALDH1A1L3MBTL1MAPTHPGD | |
| SCHEMBL2874102 | 0.78 | KDM4E (0.39) | ALDH1A1L3MBTL1MAPTPOLBTDP1 | |
| SCHEMBL3783961 | 0.78 | MAPT (0.50) | ALDH1A1CYP3A4L3MBTL1MAPTHPGD | |
| SCHEMBL23912802 | 0.78 | IDO1 (0.39) | L3MBTL1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL31345541 | 0.76 | MAPT (0.63) | ACHEALDH1A1CYP3A4L3MBTL1MAPT | |
| SCHEMBL26717551 | 0.76 | ACHE (0.52) | ACHEALDH1A1CYP3A4L3MBTL1MAPT | |
| SCHEMBL11822275 | 0.75 | TP53 (0.44) | ACHEALDH1A1CYP3A4MAPTHPGD | |
| SCHEMBL2023201 | 0.73 | TP53 (0.48) | ALDH1A1CYP3A4MAPTHPGDCYP2C9 | |
| SCHEMBL24457920 | 0.72 | GAA (0.52) | ALDH1A1CYP3A4MAPTHPGDCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3094325-B1 | HETEROARYLS AND USES THEREOF | TAKEDA PHARMACEUTICALS CO (JP) | 2021-10-13 | — | — | EP | disclosed |