Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | PAM | P19021 | 2/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25473493 | 0.86 | PAM (0.59) | ALDH1A1PAMDGKAMAPTMEN1 | |
| SCHEMBL7865303 | 0.85 | ALDH1A1 (0.55) | ALDH1A1PAMDGKAMAPTMEN1 | |
| SCHEMBL10667711 | 0.81 | — | — | |
| SCHEMBL844443 | 0.79 | ALDH1A1 (0.48) | ALDH1A1PAMDGKAMAPTTSHR | |
| SCHEMBL2231747 | 0.79 | ALDH1A1 (0.52) | ALDH1A1PAMDGKAMAPTMEN1 | |
| SCHEMBL16907299 | 0.77 | ALDH1A1 (0.56) | ALDH1A1PAMDGKAMAPTMEN1 | |
| SCHEMBL12393350 | 0.76 | ALDH1A1 (0.44) | ALDH1A1PAMDGKAMAPTMEN1 | |
| SCHEMBL21610457 | 0.76 | DGKA (0.50) | ALDH1A1PAMDGKAMAPTTSHR | |
| Ethoxycarbonyl Group SCHEMBL27921535 | 0.76 | CYP1A2 (0.45) | ALDH1A1DGKAPOLBTSHRCYP1A2 | |
| SCHEMBL28573654 | 0.74 | ALDH1A1 (0.46) | ALDH1A1PAMDGKAMAPTMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021110965-A1 | DIETARY BUTYRATE AND ITS USES | Société des Produits Nestlé S.A. (CH) | 2021-06-10 | — | — | WO | disclosed |
| WO-2021110961-A1 | DIETARY BUTYRATE AND ITS USES | Société des Produits Nestlé S.A. (CH) | 2021-06-10 | — | — | WO | disclosed |