Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16825248 | 0.89 | GAA (0.51) | GAAKDM4EHSD17B10TSHREPHX2 | |
| SCHEMBL3488684 | 0.82 | GAA (0.55) | GAAKDM4EHSD17B10TSHREPHX2 | |
| SCHEMBL6267439 | 0.79 | ROCK2 (0.45) | HSD17B10TSHRPOLBROCK2ROCK1 | |
| SCHEMBL21168215 | 0.79 | LMNA (0.47) | KDM4EHSD17B10ROCK2ROCK1PSMB5 | |
| SCHEMBL24275707 | 0.79 | GAA (0.41) | GAAKDM4EHSD17B10TSHREPHX2 | |
| SCHEMBL17132547 | 0.79 | LMNA (0.49) | HSD17B10ROCK2ROCK1PSMB5LMNA | |
| SCHEMBL7379196 | 0.78 | GNAI3 (0.51) | GAAKDM4EHSD17B10TSHREPHX2 | |
| SCHEMBL23820743 | 0.78 | GAA (0.46) | GAAKDM4EHSD17B10TSHREPHX2 | |
| SCHEMBL8254511 | 0.78 | L3MBTL1 (0.43) | GAAKDM4EHSD17B10TSHREPHX2 | |
| SCHEMBL14456049 | 0.77 | HSD17B10 (0.41) | GAAKDM4EHSD17B10TSHREPHX2 |
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-3426654-B1 | DIRECT PALLADIUM-CATALYZED AROMATIC FLUORINATION | HARVARD COLLEGE (US) | 2021-10-20 | — | — | EP | disclosed |