Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.62 |
| ▸ | BACE1 | P56817 | 2/20 | 0.62 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 8/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | MEN1 | O00255 | 6/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.57 |
| ▸ | CASP1 | P29466 | 5/20 | 0.57 |
| ▸ | CASP7 | P55210 | 5/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 6/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | SNCA | P37840 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29478212 | 0.87 | ABCB1 (0.70) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25227029 | 0.86 | MAPT (0.71) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25233130 | 0.86 | ACHE (0.81) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25204764 | 0.85 | CYP1A1 (0.67) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25205192 | 0.85 | CYP1A1 (0.67) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25234796 | 0.85 | KDM4E (0.65) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25230489 | 0.84 | CYP1B1 (0.65) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL30397364 | 0.84 | ABCB1 (0.79) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL25235022 | 0.84 | ABCB1 (0.79) | ACHEBACE1ABCB1MAPTKDM4E | |
| SCHEMBL14697046 | 0.83 | SNCA (0.56) | ACHEBACE1MAPTKDM4ECYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023242454-A1 | HYBRID MATERIAL FOR DETECTING ACID AND BASE VAPOURS | UNIVERSIDAD DE CASTILLA LA MANCHA (ES) | 2023-12-21 | — | — | WO | disclosed |