Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.47 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.47 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.45 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | MMP12 | P39900 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 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 | |
|---|---|---|---|---|
| SCHEMBL6858298 | 0.85 | CES2 (0.48) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL503667 | 0.83 | TSHR (0.53) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL29471363 | 0.83 | TSHR (0.53) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL1115079 | 0.82 | MAPK8 (0.52) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL892996 | 0.82 | MAPK8 (0.46) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL14263434 | 0.82 | RIPK1 (0.47) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL28038980 | 0.82 | CES2 (0.45) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL1478187 | 0.80 | FFAR1 (0.51) | CES2CES1 | |
| SCHEMBL13061970 | 0.79 | RIPK1 (0.49) | CES2CES1MAPK8RIPK1PSEN1 | |
| SCHEMBL1477462 | 0.79 | PSEN1 (0.42) | CES2CES1MAPK8RIPK1PSEN1 |
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-102803252-B | Be used for the treatment of indole amides derivative and the related compound thereof of neurodegenerative disorders | K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) | 2016-05-25 | — | — | CN | disclosed |