Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29503054 | 1.00 | CES2 (0.55) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL28857769 | 0.84 | TDP1 (0.43) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL27590354 | 0.82 | HPGD (0.51) | SMN1; SMN2ALDH1A1NPC1LMNAPOLB | |
| SCHEMBL5579316 | 0.82 | PRSS1 (0.53) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL10582008 | 0.78 | CES2 (0.70) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL28940687 | 0.78 | ESR2 (0.51) | CES2CES1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL29421064 | 0.78 | CES2 (0.63) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL902913 | 0.78 | PRSS1 (0.52) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL310259 | 0.78 | CES2 (0.63) | CES2CES1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL7490868 | 0.77 | CA1 (0.42) | ALDH1A1NPC1MAPTKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109651253-B | Phenylpropanoid ester derivative and application thereof as neuroprotective medicament | 上海医药工业研究院 | 2022-03-25 | — | — | CN | disclosed |
| US-7169535-B2 | Photosensitive composition and photosensitive lithographic printing plate | KONICA MINOLTA HOLDINGS, INC. (JP) | 2007-01-30 | — | — | US | disclosed |