Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.35 |
| ▸ | KCNJ6 | P48051 | 2/20 | 0.35 |
| ▸ | KCNJ3 | P48549 | 2/20 | 0.35 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.35 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | UBE2M | P61081 | 1/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3493907 | 1.00 | ALOX5 (0.36) | ALOX5KMT2ARIPK1KCNJ6KCNJ3 | |
| SCHEMBL760177 | 0.88 | ALOX5 (0.38) | ALOX5KMT2ARIPK1KCNJ6KCNJ3 | |
| SCHEMBL13435141 | 0.87 | HPGDS (0.35) | ALOX5BACE1BACE2SLC5A1 | |
| SCHEMBL4740840 | 0.83 | ADORA3 (0.41) | ALOX5BACE1BACE2ALDH1A1LMNA | |
| SCHEMBL4787016 | 0.83 | ADORA3 (0.41) | ALOX5BACE1BACE2ALDH1A1LMNA | |
| SCHEMBL757208 | 0.83 | ADORA3 (0.41) | ALOX5BACE1BACE2ALDH1A1LMNA | |
| SCHEMBL760114 | 0.83 | ADORA3 (0.41) | ALOX5BACE1BACE2ALDH1A1LMNA | |
| SCHEMBL756431 | 0.83 | ADORA3 (0.41) | ALOX5BACE1BACE2ALDH1A1LMNA | |
| SCHEMBL8240030 | 0.82 | ALOX5 (0.40) | ALOX5KMT2ABACE1ALDH1A1MAPK1 | |
| SCHEMBL757211 | 0.81 | BACE1 (0.34) | ALOX5BACE1BACE2MAPK1 |
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-2091328-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | Merck & Co., Inc. (US) | 2009-08-26 | — | — | EP | disclosed |
| WO-2008054698-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2008-05-08 | — | — | WO | disclosed |