Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL21653081 | 0.83 | SMN1; SMN2 (0.38) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653105 | 0.83 | ALDH1A1 (0.41) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653230 | 0.82 | ALDH1A1 (0.49) | RAB9ASMN1; SMN2NPC1ALDH1A1KDM4E | |
| SCHEMBL21653152 | 0.81 | BACE1 (0.42) | RAB9ASMN1; SMN2NPC1POLBBACE1 | |
| SCHEMBL21653250 | 0.81 | ALDH1A1 (0.43) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653238 | 0.80 | SMN1; SMN2 (0.38) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653080 | 0.80 | ALDH1A1 (0.42) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653240 | 0.80 | ALDH1A1 (0.45) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653124 | 0.80 | PPARG (0.40) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL21653267 | 0.79 | ALDH1A1 (0.41) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 |
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-2020023657-A1 | PYRIDIN-2-ONE COMPOUNDS USEFUL AS SMARCA2 ANTAGONISTS | Epizyme, Inc. (US) | 2020-01-30 | — | — | WO | disclosed |