Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | HSPB1 | P04792 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31168053 | 1.00 | PDE7A (0.53) | PDE7ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL22452613 | 0.85 | PDE7A (0.48) | PDE7ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL15071010 | 0.83 | RAB9A (0.59) | NPC1RAB9AALDH1A1MAPTMEN1 | |
| SCHEMBL22453327 | 0.81 | ALDH1A1 (0.55) | PDE7ARAB9AALDH1A1MAPTMEN1 | |
| SCHEMBL15071008 | 0.81 | HSPB1 (0.55) | PDE7ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL16049433 | 0.79 | HSPB1 (0.46) | PDE7ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL3190249 | 0.79 | NPC1 (0.45) | PDE7ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL18992722 | 0.77 | NPC1 (0.69) | NPC1RAB9AALDH1A1MAPTMEN1 | |
| SCHEMBL28015555 | 0.77 | ALDH1A1 (0.44) | PDE7ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL30354727 | 0.76 | NPC1 (0.49) | NPC1RAB9AALDH1A1MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113811300-A | Novel small molecule inhibitors of TEAD transcription factor | 总医院公司 | 2021-12-17 | — | — | CN | disclosed |