Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | EDNRA | P25101 | 1/20 | 0.44 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4245857 | 0.85 | EDNRA (0.55) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 | |
| SCHEMBL13702109 | 0.82 | ERN1 (0.49) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 | |
| SCHEMBL22280625 | 0.80 | LMNA (0.49) | SMN1; SMN2ALDH1A1MEN1KMT2AMAP4K4 | |
| SCHEMBL940586 | 0.79 | KEAP1 (0.59) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 | |
| SCHEMBL3076266 | 0.79 | MAP4K4 (0.61) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 | |
| SCHEMBL22280602 | 0.78 | SMN1; SMN2 (0.59) | SMN1; SMN2ALDH1A1MEN1KMT2AGRM1 | |
| SCHEMBL4249325 | 0.77 | MEN1 (0.55) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 | |
| SCHEMBL13702383 | 0.77 | NPC1 (0.52) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 | |
| SCHEMBL43683 | 0.74 | NPC1 (0.65) | SMN1; SMN2ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL13701629 | 0.74 | IMPDH2 (0.53) | ALDH1A1HDAC4MEN1KMT2AMAP4K4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020153431-A1 | ESTER COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |
| WO-2020153431-A1 | ESTER COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |