Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | AGXT | P21549 | 2/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL15539518 | 0.83 | IDO1 (0.43) | BACE1IDO1MEN1KMT2A | |
| SCHEMBL15539516 | 0.83 | IDO1 (0.43) | BACE1IDO1MEN1KMT2A | |
| SCHEMBL2807247 | 0.78 | HSD17B3 (0.45) | CHRNA7HSD17B3MAOAMAOBSLC6A19 | |
| SCHEMBL2807250 | 0.78 | HSD17B3 (0.45) | CHRNA7HSD17B3MAOAMAOBSLC6A19 | |
| SCHEMBL6156781 | 0.77 | CHRNA7 (0.43) | CHRNA7HSD17B3MAOAMAOBSLC6A19 | |
| SCHEMBL14833880 | 0.77 | CHAT (0.37) | ALDH1A1IDO1HRH4NPC1RAB9A | |
| SCHEMBL14833817 | 0.77 | CHAT (0.37) | ALDH1A1IDO1HRH4NPC1RAB9A | |
| SCHEMBL20640574 | 0.77 | NFE2L2 (0.41) | BACE1RAB9A | |
| SCHEMBL6158612 | 0.74 | HSP90AA1 (0.50) | CHRNA7HSD17B3MAOAMAOBALDH1A1 | |
| SCHEMBL20640990 | 0.74 | NFE2L2 (0.38) | BACE1 |
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-2451793-A1 | BACE INHIBITORS | Eli Lilly and Company (US) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011005738-A1 | BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2011-01-13 | — | — | WO | disclosed |