Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7565876 | 0.82 | GSK3B (0.40) | MAPTGSK3BALDH1A1 | |
| SCHEMBL8028836 | 0.80 | ESR1 (0.43) | MAPTKDM4EGAACA2CA1 | |
| SCHEMBL28468309 | 0.80 | TGM2 (0.42) | ALDH1A1HTT | |
| SCHEMBL28469749 | 0.78 | BRD4 (0.50) | GAAHTTTSHR | |
| SCHEMBL7252884 | 0.78 | HDAC3 (0.42) | GAAALDH1A1HTT | |
| SCHEMBL17902411 | 0.77 | GSK3B (0.46) | MAPTKDM4EGAAL3MBTL1GSK3B | |
| SCHEMBL28470051 | 0.75 | CYP1A2 (0.39) | MAPTALDH1A1HTTTSHR | |
| SCHEMBL8040582 | 0.75 | MAPT (0.48) | MAPTKDM4EL3MBTL1CA2CA1 | |
| SCHEMBL23833539 | 0.75 | HTT (0.46) | MAPTKDM4EGAAL3MBTL1GSK3B | |
| SCHEMBL28224852 | 0.74 | KDM4E (0.39) | KDM4ENOS3NOS1LOXL2 |
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-0440324-B1 | Substituted beta-diketones and their use in the treatment of inflammatory bowel disease | ORION YHTYMAE OY (FI) | 2000-04-12 | — | — | EP | claimed |