Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL16096077 | 0.82 | ALDH1A1 (0.47) | NPC1RAB9AALDH1A1CA1CA2 | |
| SCHEMBL27576689 | 0.80 | ALDH1A1 (0.55) | NPC1RAB9AALDH1A1MAPTKMT2A | |
| SCHEMBL29291235 | 0.77 | ALOX5 (0.50) | NPC1RAB9AALDH1A1KMT2AMAPK1 | |
| SCHEMBL27831817 | 0.73 | ALDH1A1 (0.49) | NPC1RAB9AALDH1A1CA12CA2 | |
| SCHEMBL4513357 | 0.72 | ALDH1A1 (0.50) | NPC1RAB9AALDH1A1MAPTCA12 | |
| SCHEMBL29429365 | 0.72 | FFAR1 (0.52) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL28778222 | 0.71 | NPC1 (0.42) | NPC1RAB9AALDH1A1KMT2AMAPK1 | |
| SCHEMBL28731422 | 0.71 | LMNA (0.51) | NPC1RAB9AALDH1A1L3MBTL1TDP1 | |
| SCHEMBL1990360 | 0.71 | PARP10 (0.47) | NPC1RAB9AALDH1A1CA1CA2 | |
| SCHEMBL156297 | 0.71 | CA12 (0.62) | NPC1RAB9AALDH1A1CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103492404-B | C-4' substituted macrolide derivatives | 大正制药株式会社 | 2016-09-07 | — | — | CN | disclosed |