Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 2/20 | 0.34 |
| ▸ | BACE1 | P56817 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17395036 | 1.00 | PLAU (0.34) | PLAUBACE1NPSR1RAB9ASMN1; SMN2 | |
| SCHEMBL4586975 | 0.81 | PLAU (0.40) | PLAUBACE1NPSR1RAB9ASMN1; SMN2 | |
| SCHEMBL18097794 | 0.79 | S1PR1 (0.36) | PLAUBACE1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL18097792 | 0.79 | S1PR1 (0.36) | PLAUBACE1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL16461853 | 0.79 | BACE1 (0.35) | PLAUBACE1NPSR1MAPTHPGD | |
| SCHEMBL16461854 | 0.79 | BACE1 (0.35) | PLAUBACE1NPSR1MAPTHPGD | |
| SCHEMBL16505976 | 0.78 | RAB9A (0.39) | BACE1RAB9ASMN1; SMN2KDM4EPOLB | |
| SCHEMBL2169708 | 0.77 | NPSR1 (0.49) | PLAUNPSR1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL2169704 | 0.77 | NPSR1 (0.49) | PLAUNPSR1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL287320 | 0.74 | HCAR2 (0.42) | RAB9ASMN1; SMN2KDM4EPOLBALDH1A1 |
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-2016001266-A1 | FLUORO-[1,3]OXAZINES AS BACE1 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2016-01-07 | — | — | WO | disclosed |