Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.55 |
| ▸ | PTPRB | P23467 | 1/20 | 0.53 |
| ▸ | CDC25A | P30304 | 1/20 | 0.53 |
| ▸ | CDC25B | P30305 | 1/20 | 0.53 |
| ▸ | PTEN | P60484 | 1/20 | 0.53 |
| ▸ | PTPMT1 | Q8WUK0 | 1/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | THRA | P10827 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10411183 | 0.98 | ALDH1A1 (0.57) | ALDH1A1GAAALOX15KEAP1PTPRB | |
| SCHEMBL7322435 | 0.86 | ALDH1A1 (0.56) | ALDH1A1GAAALOX15PTPRBCDC25A | |
| SCHEMBL6179341 | 0.85 | ALDH1A1 (0.54) | ALDH1A1GAAALOX15FFAR1KMT2A | |
| SCHEMBL11287913 | 0.84 | ALDH1A1 (0.53) | ALDH1A1GAAALOX15PTPRBCDC25A | |
| SCHEMBL3679227 | 0.83 | THRA (0.67) | ALDH1A1KEAP1PTPRBCDC25ACDC25B | |
| SCHEMBL2553049 | 0.82 | KMT2A (0.54) | ALDH1A1GAAALOX15KMT2AL3MBTL1 | |
| SCHEMBL70271 | 0.81 | KEAP1 (0.74) | KEAP1PTPRBCDC25ACDC25BPTEN | |
| SCHEMBL11298255 | 0.81 | ALDH1A1 (0.53) | ALDH1A1GAAALOX15KMT2AL3MBTL1 | |
| SCHEMBL4593938 | 0.80 | ALDH1A1 (0.49) | ALDH1A1GAAALOX15KMT2AL3MBTL1 | |
| SCHEMBL5593599 | 0.80 | CYP1A2 (0.51) | ALDH1A1GAAALOX15KEAP1FFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |