Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.50 |
| ▸ | S100B | P04271 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1225547 | 0.77 | ALDH1A1 (0.42) | KMT2AALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL1225545 | 0.77 | ALDH1A1 (0.42) | KMT2AALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL1110733 | 0.77 | CYP1A2 (0.45) | KMT2AALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL11410209 | 0.77 | CYP1A2 (0.42) | KMT2AALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL11410203 | 0.77 | CYP1A2 (0.42) | KMT2AALDH1A1L3MBTL1MAPTMEN1 | |
| SCHEMBL5437012 | 0.76 | S100B (0.70) | KMT2AS100BALDH1A1L3MBTL1MAPT | |
| SCHEMBL2904627 | 0.76 | S100B (0.70) | KMT2AS100BALDH1A1L3MBTL1MAPT | |
| SCHEMBL2904629 | 0.76 | S100B (0.70) | KMT2AS100BALDH1A1L3MBTL1MAPT | |
| SCHEMBL5437008 | 0.76 | S100B (0.70) | KMT2AS100BALDH1A1L3MBTL1MAPT | |
| SCHEMBL12416630 | 0.72 | S100B (0.82) | KMT2AS100BALDH1A1L3MBTL1MAPT |
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-2018048969-A1 | MULTI-TARGETED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2018-03-15 | — | — | WO | disclosed |