Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6067645 | 0.92 | ALDH1A1 (0.53) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL6067713 | 0.84 | MAPT (0.46) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL9721377 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL6067608 | 0.79 | ALDH1A1 (0.48) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL9437333 | 0.79 | MEN1 (0.51) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL6067718 | 0.77 | ALDH1A1 (0.46) | ALDH1A1MAPTPIN1MEN1KMT2A | |
| SCHEMBL6067631 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MAPTMEN1KMT2ARECQL | |
| SCHEMBL5885245 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL21841092 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MAPTPOLBNPSR1PIN1 | |
| SCHEMBL7065146 | 0.74 | MMP8 (0.51) | ALDH1A1MAPTPOLBNPSR1PIN1 |
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-2006100606-A2 | PREPARATION OF BETA-AMINO ACID PRECURSORS VIA INDIUM (III) MEDIATED MARKOVNIKOV ADDITION AND KNOEVENAGEL CONDENSATION | WARNER-LAMBERT COMPANY LLC (US) | 2006-09-28 | — | — | WO | disclosed |