Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10155562 | 0.86 | — | — | |
| Duroquinone SCHEMBL58325 | 0.80 | MAOA (0.38) | CTSDMAOAMAOB | |
| SCHEMBL13581861 | 0.76 | MAOA (0.36) | CTSDMAOAMAOB | |
| Duroquinone SCHEMBL11473070 | 0.76 | MAOA (0.36) | CTSDMAOAMAOB | |
| SCHEMBL14459682 | 0.74 | — | — | |
| SCHEMBL10486657 | 0.68 | MAOA (0.36) | CTSDMAOAMAOB | |
| SCHEMBL13431173 | 0.67 | DUSP3 (0.39) | CTSD | |
| Duroquinone SCHEMBL11701942 | 0.67 | MAOA (0.38) | MAOAMAOB | |
| SCHEMBL10035859 | 0.65 | — | — | |
| SCHEMBL12156967 | 0.65 | — | — |
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-2018053313-A1 | ADENOSINE ANALOGS AS METHYLTRANSFERASE INHIBITORS FOR TREATING CANCER | MEMORIAL SLOAN-KETTERING CANCER CENTER (US) | 2018-03-22 | — | — | WO | disclosed |