Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.39 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.39 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PRCP | P42785 | 2/20 | 0.34 |
| ▸ | TPH1 | P17752 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL22862705 | 1.00 | NUDT1 (0.39) | NUDT1DNMT1DNMT3LDNMT3AGAA | |
| SCHEMBL22862634 | 0.92 | AKR1C3 (0.35) | NUDT1PRCPMAPTNPSR1CAMK2D | |
| SCHEMBL22862650 | 0.83 | NUDT1 (0.47) | NUDT1DNMT1DNMT3LDNMT3AGAA | |
| SCHEMBL29490277 | 0.80 | NPC1 (0.33) | MAPTRAB9APKML3MBTL1LDHA | |
| SCHEMBL22862606 | 0.80 | NPC1 (0.33) | MAPTRAB9APKML3MBTL1LDHA | |
| SCHEMBL22862592 | 0.79 | KCNN3 (0.42) | RAB9AL3MBTL1MEN1KMT2ANPC1 | |
| SCHEMBL22862661 | 0.78 | NUDT1 (0.52) | NUDT1DNMT1DNMT3LDNMT3AGAA | |
| SCHEMBL22862702 | 0.77 | LDHA (0.36) | MAPTNPSR1L3MBTL1LDHAVNN1 | |
| SCHEMBL22862676 | 0.77 | SMN1; SMN2 (0.36) | MAPTNPSR1RAB9APKML3MBTL1 | |
| SCHEMBL29490179 | 0.77 | SMN1; SMN2 (0.36) | MAPTNPSR1RAB9APKML3MBTL1 |
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-2021002986-A2 | BAX INHIBITORS AND USES THEREOF | CASE WESTERN RESERVE UNIVERSITY (US) | 2021-01-07 | — | — | WO | disclosed |