Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 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 | |
|---|---|---|---|---|
| SCHEMBL5139240 | 0.85 | ALDH1A1 (0.55) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL22539528 | 0.85 | ALDH1A1 (0.55) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL25670286 | 0.82 | ALDH1A1 (0.61) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL23817240 | 0.82 | ALDH1A1 (0.61) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL24006144 | 0.80 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL24006143 | 0.80 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL28797838 | 0.79 | ALDH1A1 (0.58) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL15161512 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HCAR2TDP1CA12CA9 | |
| SCHEMBL1554123 | 0.77 | ALDH1A1 (0.55) | ALDH1A1RAB9ANPC1HCAR2TDP1 | |
| SCHEMBL24066338 | 0.76 | ALDH1A1 (0.53) | ALDH1A1RAB9ANPC1HCAR2TDP1 |
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-2017116702-A1 | ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS | MERIAL, INC. (US) | 2017-07-06 | — | — | WO | disclosed |