Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 9/20 | 0.34 |
| ▸ | BACE2 | Q9Y5Z0 | 5/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL38656117 | 0.84 | PDK2 (0.41) | BACE1BACE2PDK2ALDH1A1LMNA | |
| SCHEMBL12225794 | 0.75 | BACE1 (0.40) | BACE1ALDH1A1 | |
| SCHEMBL803450 | 0.73 | HDAC4 (0.40) | PDK2 | |
| SCHEMBL6606358 | 0.72 | ALDH1A1 (0.44) | BACE1BACE2PDK2ALDH1A1LMNA | |
| SCHEMBL12983307 | 0.72 | PDK2 (0.40) | BACE1BACE2PDK2ALDH1A1LMNA | |
| SCHEMBL6773375 | 0.69 | NR1H2 (0.40) | BACE1BACE2PDK2MAPT | |
| SCHEMBL6395577 | 0.68 | BACE1 (0.36) | BACE1BACE2ALDH1A1LMNAMAPT | |
| SCHEMBL30695923 | 0.68 | BACE1 (0.36) | BACE1BACE2 | |
| SCHEMBL23206456 | 0.68 | ALDH1A1 (0.42) | BACE1BACE2PDK2ALDH1A1LMNA | |
| SCHEMBL31549182 | 0.67 | CYP1A2 (0.39) | BACE1BACE2PDK2ALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1448536-A1 | CYCLOPROPYL-CONTAINING OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF | Merck & Co., Inc. (US) | 2004-08-25 | — | — | EP | disclosed |
| WO-2003048136-A1 | CYCLOPROPYL HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTICS AND DERIVATIVES THEREOF | MERCK & CO., INC. (US) | 2003-06-12 | — | — | WO | disclosed |