Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 9/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12277147 | 0.90 | ACHE (0.55) | ACHEADORA3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL22979081 | 0.87 | ACHE (0.58) | ACHEKDM4EALDH1A1KMT2AGSK3B | |
| SCHEMBL22036373 | 0.79 | ACHE (0.62) | ACHEALDH1A1SMN1; SMN2TSHRRAB9A | |
| SCHEMBL1197941 | 0.78 | CYP2C9 (0.44) | ACHEALDH1A1SMN1; SMN2KMT2ATSHR | |
| SCHEMBL3380597 | 0.77 | ACHE (0.50) | ACHEALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL1198561 | 0.77 | ACHE (0.41) | ACHEADORA3ADORA2AADORA1KDM4E | |
| SCHEMBL16050383 | 0.77 | ACHE (0.50) | ACHEKDM4EALDH1A1SMN1; SMN2GAA | |
| SCHEMBL18937221 | 0.77 | ACHE (0.60) | ACHEALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6233599 | 0.76 | ACHE (0.63) | ACHEADORA3KDM4EALDH1A1MEN1 | |
| SCHEMBL29014777 | 0.75 | ACHE (0.48) | ACHEALDH1A1SMN1; SMN2KMT2ATSHR |
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-4013508-A1 | [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES | Bayer Aktiengesellschaft (DE) | 2022-06-22 | — | — | EP | disclosed |