Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 11/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3479552 | 0.88 | BACE1 (0.57) | BACE1 | |
| SCHEMBL8203989 | 0.82 | BACE1 (0.43) | BACE1MEN1KMT2ACYP3A4BACE2 | |
| SCHEMBL8209469 | 0.82 | BACE1 (0.43) | BACE1MEN1KMT2ACACNA1FCHRM2 | |
| SCHEMBL8197624 | 0.80 | BACE1 (0.51) | BACE1MEN1KMT2ACYP2D6ALOX15 | |
| SCHEMBL3479484 | 0.80 | BACE1 (0.56) | BACE1 | |
| SCHEMBL8269167 | 0.79 | BACE1 (0.49) | BACE1MEN1KMT2ACYP2D6ALOX15 | |
| SCHEMBL594221 | 0.79 | BACE1 (0.49) | BACE1MEN1KMT2ACYP2D6ALOX15 | |
| SCHEMBL3479379 | 0.79 | BACE1 (0.59) | BACE1 | |
| SCHEMBL15146194 | 0.77 | BACE1 (0.45) | BACE1MEN1KMT2ACYP2D6ALOX15 | |
| SCHEMBL593029 | 0.77 | BACE1 (0.43) | BACE1MEN1KMT2ACYP2D6MAPK1 |
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-2008030412-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2008-03-13 | — | — | WO | disclosed |