Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL375312 | 1.00 | GRIK1 (0.55) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL393958 | 0.95 | GRIK1 (0.54) | GRIK1KDM4EMEN1KMT2ALMNA | |
| Maleic Acid SCHEMBL8995943 | 0.94 | GRIK1 (0.50) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL905410 | 0.94 | TDP1 (0.52) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL7780529 | 0.94 | TDP1 (0.52) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL27364020 | 0.94 | GRIK1 (0.49) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL7107526 | 0.94 | TDP1 (0.52) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL11445983 | 0.94 | TDP1 (0.52) | GRIK1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL10904990 | 0.94 | TDP1 (0.52) | GRIK1KDM4EMEN1KMT2ALMNA | |
| Methacrylic Acid SCHEMBL2912337 | 0.93 | GRIK1 (0.49) | GRIK1KDM4EMEN1KMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3896053-A1 | METHOD FOR DIRECTLY CONSTRUCTING TETRA-SUBSTITUTED ALLENIC ACID COMPOUND HAVING HIGH OPTICAL ACTIVITY | Fudan University (CN) | 2021-10-20 | — | — | EP | disclosed |