Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL16825171 | 0.83 | NPSR1 (0.44) | ACHETSHRMCOLN3KMT2AUSP2 | |
| SCHEMBL11548078 | 0.78 | CA12 (0.52) | TSHRKMT2AMEN1L3MBTL1ALDH1A1 | |
| SCHEMBL29995599 | 0.78 | CA12 (0.52) | TSHRKMT2AMEN1L3MBTL1ALDH1A1 | |
| SCHEMBL12518 | 0.74 | ACHE (1.00) | ACHETSHRKMT2AUSP2GAA | |
| SCHEMBL29403877 | 0.74 | ACHE (1.00) | ACHETSHRKMT2AUSP2GAA | |
| SCHEMBL28914269 | 0.74 | CHRM3 (0.39) | MCOLN3KMT2AGAAMEN1NPC1 | |
| SCHEMBL12385910 | 0.74 | ALDH1A1 (0.59) | ACHETSHRMCOLN3USP2L3MBTL1 | |
| Hydrochloric Acid SCHEMBL27523444 | 0.72 | ACHE (0.95) | ACHETSHRKMT2AUSP2GAA | |
| Ammonia Solution, Strong SCHEMBL27765317 | 0.72 | ACHE (0.95) | ACHETSHRKMT2AUSP2GAA | |
| SCHEMBL8342531 | 0.71 | ALDH1A1 (0.61) | ACHETSHRMCOLN3KMT2AUSP2 |
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-115210225-A | Substituted aminoquinolones as immuno-activated DGKALPHA inhibitors | 拜耳公司 | 2022-10-18 | — | — | CN | disclosed |