Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.33 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.33 |
| ▸ | KCNE1 | P15382 | 2/20 | 0.33 |
| ▸ | KCNQ1 | P51787 | 2/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16166183 | 1.00 | ALDH1A1 (0.37) | ALDH1A1LMNAMAPTPTGS2KMT2A | |
| SCHEMBL29202700 | 0.82 | ALDH1A1 (0.38) | ALDH1A1LMNAKMT2AGAAMEN1 | |
| SCHEMBL1760173 | 0.82 | KEAP1 (0.41) | ALDH1A1MAPTKMT2AGAAMEN1 | |
| SCHEMBL16176006 | 0.80 | CASP3 (0.33) | — | |
| SCHEMBL15651124 | 0.80 | IKBKB (0.40) | ALDH1A1LMNAKMT2AGAAMEN1 | |
| SCHEMBL24859645 | 0.79 | TSHR (0.41) | ALDH1A1MAPTKMT2AGAAMEN1 | |
| SCHEMBL30054378 | 0.79 | NPSR1 (0.47) | ALDH1A1LMNAMAPTKMT2AGAA | |
| SCHEMBL2894142 | 0.79 | NPSR1 (0.47) | ALDH1A1LMNAMAPTKMT2AGAA | |
| SCHEMBL18412839 | 0.79 | GAA (0.42) | ALDH1A1LMNAMAPTKMT2AGAA | |
| SCHEMBL18498680 | 0.79 | CTSA (0.40) | PTGS2KMT2AGAAMEN1RAB9A |
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-119173511-A | Benzotriazole compounds | 第一三共株式会社 | 2024-12-20 | — | — | CN | disclosed |