Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.45 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.44 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.44 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GRN | P28799 | 1/20 | 0.41 |
| ▸ | SORT1 | Q99523 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30999691 | 0.86 | PTGS2 (0.51) | PTGS1PTGS2PDPK1 | |
| SCHEMBL31364572 | 0.84 | PTGS2 (0.60) | PTGS1PTGS2PDPK1NR3C2CYP1A2 | |
| SCHEMBL31364574 | 0.84 | PTGS2 (0.60) | PTGS1PTGS2PDPK1NR3C2CYP1A2 | |
| SCHEMBL12705320 | 0.84 | GRN (0.59) | KDM4EALDH1A1MAPTGRNSORT1 | |
| Hydrochloric Acid SCHEMBL14663451 | 0.83 | PTGS2 (0.46) | PTGS1PTGS2KDM4EALDH1A1KLKB1 | |
| SCHEMBL1672108 | 0.80 | PTGS1 (0.62) | PTGS1PTGS2ALDH1A1MAPT | |
| SCHEMBL15478687 | 0.78 | PTGS1 (0.63) | PTGS1PTGS2PDPK1KCNJ6KCNJ5 | |
| SCHEMBL4650993 | 0.78 | PTGS1 (0.63) | PTGS1PTGS2PDPK1KCNJ6KCNJ5 | |
| SCHEMBL28295438 | 0.78 | KDM4C (0.45) | PTGS1PTGS2KDM4EALDH1A1MAPT | |
| SCHEMBL7570850 | 0.76 | PTGS1 (0.65) | PTGS1PTGS2PDPK1KDM4EALDH1A1 |
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-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 |