Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | SLC13A5 | Q86YT5 | 3/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22845583 | 0.85 | ALDH1A1 (0.48) | ALDH1A1RECQLMMP8L3MBTL1POLB | |
| SCHEMBL755369 | 0.85 | ALDH1A1 (0.48) | ALDH1A1RECQLMMP8L3MBTL1POLB | |
| SCHEMBL14510426 | 0.76 | ALDH1A1 (0.42) | ALDH1A1RECQLMMP8L3MBTL1POLB | |
| SCHEMBL18065668 | 0.75 | ALDH1A1 (0.51) | ALDH1A1RECQLMMP8L3MBTL1TAAR1 | |
| SCHEMBL7616395 | 0.75 | ALDH1A1 (0.48) | ALDH1A1RECQLMMP8L3MBTL1TAAR1 | |
| SCHEMBL15419571 | 0.74 | MMP8 (0.54) | ALDH1A1RECQLMMP8L3MBTL1TAAR1 | |
| SCHEMBL7617566 | 0.74 | MMP8 (0.61) | ALDH1A1RECQLMMP8L3MBTL1TAAR1 | |
| SCHEMBL30513307 | 0.74 | ALDH1A1 (0.60) | ALDH1A1RECQLMMP8L3MBTL1POLB | |
| SCHEMBL22666025 | 0.73 | ALDH1A1 (0.49) | ALDH1A1RECQLMMP8L3MBTL1NPSR1 | |
| SCHEMBL18065664 | 0.73 | ALDH1A1 (0.49) | ALDH1A1RECQLMMP8L3MBTL1POLB |
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-20200407756-A1 | PREPARATION OF TERTIARY ALCOHOLS, RESOLUTION OF TERTIARY ALCOHOLS AND STEREOSELECTIVE DEUTERATION OR TRITIATION BY RETROALDOLASES | ETH ZUERICH (CH) | 2020-12-31 | — | — | US | disclosed |