Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6186865 | 0.76 | EPHX2 (0.51) | ALDH1A1POLBTSHR | |
| SCHEMBL6183700 | 0.72 | CTSL (0.53) | ALDH1A1TP53MAPK1TSHR | |
| SCHEMBL6181973 | 0.70 | PIK3CA (0.47) | — | |
| SCHEMBL6182156 | 0.70 | NAMPT (0.51) | — | |
| SCHEMBL6185113 | 0.70 | POLB (0.42) | ALDH1A1POLBTSHR | |
| SCHEMBL7551492 | 0.69 | SMN1; SMN2 (0.41) | ALDH1A1 | |
| SCHEMBL6183061 | 0.68 | CD274 (0.49) | ALDH1A1POLBTSHR | |
| SCHEMBL7449982 | 0.68 | POLB (0.47) | ALDH1A1POLBTP53TSHR | |
| SCHEMBL6203504 | 0.68 | LOXL2 (0.42) | — | |
| SCHEMBL6182408 | 0.68 | GAA (0.46) | POLBMAPK1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001068645-A2 | N-CYANOMETHYLCARBOXAMIDES AND THEIR USE AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-09-20 | — | — | WO | claimed |