Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30519250 | 1.00 | NPC1 (0.42) | NPC1RAB9AL3MBTL1ALDH1A1PKM | |
| SCHEMBL31565827 | 0.88 | L3MBTL1 (0.41) | NPC1RAB9AL3MBTL1ALDH1A1PKM | |
| SCHEMBL31566065 | 0.88 | NPC1 (0.40) | NPC1RAB9AL3MBTL1ALDH1A1PKM | |
| SCHEMBL25430398 | 0.87 | L3MBTL1 (0.42) | NPC1RAB9AL3MBTL1ALDH1A1ESR1 | |
| SCHEMBL31565972 | 0.86 | L3MBTL1 (0.42) | NPC1RAB9AL3MBTL1ALDH1A1ESR1 | |
| SCHEMBL30519194 | 0.84 | ESR1 (0.42) | L3MBTL1ALDH1A1ESR1ESR2TP53 | |
| SCHEMBL25429255 | 0.84 | ESR1 (0.42) | L3MBTL1ALDH1A1ESR1ESR2TP53 | |
| SCHEMBL31565932 | 0.84 | ALDH1A1 (0.47) | L3MBTL1ALDH1A1ESR1ESR2TP53 | |
| SCHEMBL31565856 | 0.83 | L3MBTL1 (0.40) | NPC1RAB9AL3MBTL1ALDH1A1ESR1 | |
| SCHEMBL25428445 | 0.83 | ALDH1A1 (0.41) | NPC1RAB9AL3MBTL1ALDH1A1ESR1 |
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-2023147063-A2 | COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR | Opna Bio SA (CH) | 2023-08-03 | — | — | WO | disclosed |