Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22958654 | 1.00 | CA12 (0.35) | CA12CA9ALOX5GAAKDM4E | |
| SCHEMBL22958738 | 0.95 | MAPT (0.37) | CA12CA9ALOX5GAAKDM4E | |
| SCHEMBL19038403 | 0.93 | PRKDC (0.35) | CA12CA9ALOX5GAAKDM4E | |
| SCHEMBL19038404 | 0.93 | ALDH1A1 (0.36) | CA12CA9ALOX5GAAKDM4E | |
| SCHEMBL22958649 | 0.93 | ALDH1A1 (0.36) | CA12CA9ALOX5GAAKDM4E | |
| SCHEMBL20199989 | 0.92 | MAPT (0.35) | CA12CA9MEN1KMT2AMAPT | |
| SCHEMBL25636726 | 0.92 | MEN1 (0.38) | CA12CA9GAAKDM4EMEN1 | |
| SCHEMBL22958669 | 0.91 | ESR1 (0.41) | CA9ALOX5KDM4EMEN1KMT2A | |
| SCHEMBL20199998 | 0.90 | MAPT (0.36) | CA12CA9MEN1KMT2AMAPT | |
| SCHEMBL22958653 | 0.90 | MGLL (0.33) | GAAKDM4EMEN1KMT2AMAPT |
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-20210043852-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-02-11 | — | — | US | disclosed |