Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ALPG | P10696 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.44 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 6/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL18510017 | 0.83 | ALDH1A1 (0.52) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL18510055 | 0.83 | ALDH1A1 (0.52) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL28470227 | 0.83 | EPHX1 (0.46) | ALDH1A1NPSR1ALPGPPARGHTT | |
| SCHEMBL11118373 | 0.82 | NPSR1 (0.43) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL14304682 | 0.82 | ALDH1A1 (0.50) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL807264 | 0.82 | ALDH1A1 (0.50) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL31424894 | 0.82 | ACHE (0.40) | ALDH1A1NPSR1ALPGPPARGHTT | |
| SCHEMBL7770638 | 0.80 | TSHR (0.49) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL13633220 | 0.80 | NPSR1 (0.50) | ALDH1A1NPSR1ATMALPGPPARG | |
| SCHEMBL11190201 | 0.80 | ALDH1A1 (0.48) | ALDH1A1NPSR1ATMALPGPPARG |
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-2014165792-A2 | MACROLIDES AND METHODS OF THEIR PREPARATION AND USE | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2014-10-09 | — | — | WO | disclosed |