Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 2/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21612789 | 0.81 | KDM4E (0.42) | KDM4EALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL23368034 | 0.80 | KDM4E (0.50) | KDM4EALDH1A1LRRK2MAPTNPC1 | |
| Trifluoroacetic Acid SCHEMBL23355399 | 0.74 | KDM4E (0.45) | KDM4EALDH1A1LRRK2MAPTCA1 | |
| SCHEMBL23355377 | 0.74 | KDM4E (0.44) | KDM4EALDH1A1MAPTTP53TNKS | |
| SCHEMBL23355402 | 0.72 | KDM4E (0.41) | KDM4EALDH1A1MAPTTP53BACE1 | |
| SCHEMBL16989718 | 0.71 | KDM4E (0.58) | KDM4EALDH1A1LRRK2MAPTNPC1 | |
| SCHEMBL16989719 | 0.71 | KDM4E (0.58) | KDM4EALDH1A1LRRK2MAPTNPC1 | |
| SCHEMBL23368199 | 0.70 | KDM4E (0.40) | KDM4EALDH1A1MAPTTP53BACE1 | |
| SCHEMBL16989772 | 0.69 | KDM4E (0.54) | KDM4EALDH1A1LRRK2MAPTNPC1 | |
| SCHEMBL16989771 | 0.69 | KDM4E (0.54) | KDM4EALDH1A1LRRK2MAPTNPC1 |
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-2020009156-A1 | BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVE | 第一三共株式会社 | 2020-01-09 | — | — | WO | disclosed |