Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP2 | O95551 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | RPA1 | P27694 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 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 | |
|---|---|---|---|---|
| SCHEMBL2514163 | 0.79 | MAPK1 (0.56) | KDM4CLMNAHTTALDH1A1CYP1A2 | |
| SCHEMBL4850941 | 0.79 | KDM4C (0.49) | KDM4CATMLMNAHTTALDH1A1 | |
| SCHEMBL28957484 | 0.78 | PTGS1 (0.58) | ALDH1A1CYP1A2PTGS2PTGS1KDM4E | |
| SCHEMBL27927533 | 0.77 | ALDH1A1 (0.53) | LMNAALDH1A1MAPK1MEN1KMT2A | |
| SCHEMBL27520726 | 0.76 | RPA1 (0.59) | ALDH1A1RPA1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL28701069 | 0.75 | ATM (0.43) | KDM4CATMLMNAHTTALDH1A1 | |
| SCHEMBL12705320 | 0.75 | GRN (0.59) | LMNAALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL27452606 | 0.73 | NPC1 (0.44) | KDM4CATMLMNAHTTPOLB | |
| SCHEMBL5011596 | 0.70 | PTGS1 (0.63) | POLBALDH1A1PTGS2PTGS1MEN1 | |
| SCHEMBL4852255 | 0.70 | PKM (0.43) | HTTALDH1A1MEN1KMT2ANPC1 |
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 |
| CN-109651253-A | Cinnamic acid ester derivant and its application as nerve protection medicine | 上海医药工业研究院 | 2019-04-19 | — | — | CN | disclosed |