Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 7/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7948929 | 0.91 | ATM (0.41) | ATML3MBTL1BACE1AKR1B1 | |
| SCHEMBL7958771 | 0.89 | ATM (0.40) | ATML3MBTL1BACE1LMNAPKM | |
| SCHEMBL7948498 | 0.78 | AKR1B1 (0.43) | AKR1B1 | |
| SCHEMBL7964975 | 0.78 | AKR1B1 (0.41) | BACE1LMNAPKMAKR1B1 | |
| SCHEMBL7958287 | 0.77 | BACE1 (0.42) | ATML3MBTL1BACE1LMNAPKM | |
| SCHEMBL7949438 | 0.77 | AKR1B1 (0.38) | AKR1B1 | |
| SCHEMBL7948443 | 0.76 | BACE1 (0.37) | L3MBTL1BACE1LMNAPKMAKR1B1 | |
| SCHEMBL7948410 | 0.76 | BACE1 (0.41) | BACE1LMNAPKMAKR1B1CTSD | |
| SCHEMBL7963773 | 0.76 | AKR1B1 (0.44) | AKR1B1 | |
| SCHEMBL7948846 | 0.75 | AKR1B1 (0.43) | AKR1B1 |
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-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |