Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EED | O75530 | 2/20 | 0.66 |
| ▸ | HTR1A | P08908 | 2/20 | 0.65 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | AGXT | P21549 | 2/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13681485 | 0.93 | EED (0.59) | EEDHTR1ASLC6A4ALDH1A1TAAR1 | |
| SCHEMBL25698257 | 0.93 | EED (0.71) | EEDHTR1ASLC6A4ALDH1A1TAAR1 | |
| SCHEMBL5346621 | 0.92 | EED (0.58) | EEDHTR1ASLC6A4ALDH1A1TAAR1 | |
| SCHEMBL13503611 | 0.89 | EED (0.56) | EEDHTR1ASLC6A4ALDH1A1TAAR1 | |
| SCHEMBL31152575 | 0.89 | EED (0.70) | EEDHTR1ASLC6A4ALDH1A1 | |
| SCHEMBL3966125 | 0.89 | EED (0.58) | EEDHTR1ASLC6A4ALDH1A1TAAR1 | |
| SCHEMBL3966127 | 0.89 | EED (0.70) | EEDHTR1ASLC6A4ALDH1A1 | |
| SCHEMBL14421472 | 0.87 | HTR1A (0.71) | EEDHTR1ASLC6A4SIGMAR1 | |
| Hydrochloric Acid SCHEMBL29463792 | 0.87 | EED (0.68) | EEDHTR1ASLC6A4ALDH1A1IDO1 | |
| Hydrochloric Acid SCHEMBL18280041 | 0.87 | EED (0.68) | EEDHTR1ASLC6A4ALDH1A1IDO1 |
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-101238124-A | Spiropiperidine beta-secretase inhibitors for the treatment of Alzheimer's disease | MERCK & CO INC (US) | 2008-08-06 | — | — | CN | disclosed |