Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.44 |
| ▸ | LY96 | Q9Y6Y9 | 2/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | TFEB | P19484 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 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 | |
|---|---|---|---|---|
| SCHEMBL7144518 | 1.00 | KDM1A (0.44) | KDM1ALY96PRKDCLCKFYN | |
| SCHEMBL7135372 | 0.91 | KDM1A (0.46) | KDM1ALY96PRKDCARABCB1 | |
| SCHEMBL7136375 | 0.91 | KDM1A (0.46) | KDM1ALY96PRKDCARABCB1 | |
| SCHEMBL7140256 | 0.85 | LY96 (0.47) | LY96ARABCB1MAPTMAOB | |
| SCHEMBL7140258 | 0.85 | LY96 (0.47) | LY96ARABCB1MAPTMAOB | |
| SCHEMBL7136713 | 0.81 | ABCB1 (0.49) | ABCB1MAPTLMNAMEN1KMT2A | |
| SCHEMBL7136707 | 0.81 | ABCB1 (0.49) | ABCB1MAPTLMNAMEN1KMT2A | |
| SCHEMBL7139096 | 0.80 | MAOB (0.42) | ARMAOBNFE2L2LMNAMEN1 | |
| SCHEMBL7139094 | 0.80 | MAOB (0.42) | ARMAOBNFE2L2LMNAMEN1 | |
| SCHEMBL7138677 | 0.77 | HCAR2 (0.41) | ARABCB1MAPTMAOBTFEB |
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-0996439-B1 | BETA-ALKOXYACRYLATES AGAINST MALARIA | HOFFMANN LA ROCHE (CH) | 2003-01-08 | — | — | EP | claimed |