Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 9/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL8512252 | 0.91 | BACE1 (0.36) | BACE1CTSDNPSR1KDM4EMAPT | |
| SCHEMBL2371832 | 0.84 | BACE1 (0.34) | BACE1CTSD | |
| SCHEMBL8513669 | 0.82 | AKR1B1 (0.35) | BACE1CTSDAKR1B1 | |
| SCHEMBL8512549 | 0.82 | BACE1 (0.40) | BACE1CTSDNPSR1KDM4EMAPT | |
| SCHEMBL8513814 | 0.78 | BACE1 (0.32) | BACE1CTSDNPSR1KDM4EMAPT | |
| SCHEMBL8513817 | 0.78 | BACE1 (0.32) | BACE1CTSDNPSR1KDM4EMAPT | |
| SCHEMBL2370550 | 0.76 | BACE1 (0.32) | BACE1CTSD | |
| SCHEMBL12213462 | 0.75 | BACE1 (0.30) | BACE1 | |
| SCHEMBL2370774 | 0.73 | AKR1B1 (0.35) | BACE1CTSDAKR1B1 | |
| SCHEMBL2370489 | 0.71 | BACE1 (0.37) | BACE1CTSDAKR1B1 |
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-2012071279-A1 | SPIRO-AMINO-IMIDAZOLONE AND SPIRO-AMINO-DIHYDRO-PYRIMIDINONE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE | AMGEN INC. (US) | 2012-05-31 | — | — | WO | disclosed |