Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | CTSD | P07339 | 3/20 | 0.40 |
| ▸ | BACE1 | P56817 | 3/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.31 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.31 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4030544 | 0.84 | SMN1; SMN2 (0.39) | BTKCTSDBACE1BACE2SSTR4 | |
| SCHEMBL4028317 | 0.84 | BTK (0.43) | BTKCTSDBACE1BACE2LMNA | |
| SCHEMBL3942643 | 0.84 | SMN1; SMN2 (0.39) | BTKCTSDBACE1BACE2SSTR4 | |
| SCHEMBL3942662 | 0.83 | BTK (0.42) | BTKCTSDBACE1BACE2LMNA | |
| SCHEMBL8128948 | 0.79 | LMNA (0.43) | BTKLMNASSTR4MAPK1HTT | |
| SCHEMBL14436576 | 0.78 | BTK (0.49) | BTKLMNATSHREPHX2ANPEP | |
| SCHEMBL863425 | 0.78 | BTK (0.49) | BTKLMNATSHREPHX2ANPEP | |
| SCHEMBL20047617 | 0.78 | BTK (0.49) | BTKLMNATSHREPHX2ANPEP | |
| SCHEMBL15850711 | 0.78 | SSTR4 (0.34) | BTKCTSDBACE1BACE2LMNA | |
| SCHEMBL18628568 | 0.77 | BTK (0.47) | BTKLMNATSHREPHX2ANPEP |
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-2009013293-A1 | SUBSTITUTED CYCLOHEXANECARBOXAMIDES USEFUL AS BACE INHIBITORS | NOVARTIS AG (CH) | 2009-01-29 | — | — | WO | disclosed |