Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 6/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | NPR1 | P16066 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.34 |
| ▸ | SMO | Q99835 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 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 | |
|---|---|---|---|---|
| SCHEMBL9354 | 0.75 | BACE1 (0.62) | GRM5BACE1 | |
| SCHEMBL14273 | 0.65 | BACE1 (0.41) | BACE1 | |
| SCHEMBL8662 | 0.65 | BACE1 (0.75) | BACE1 | |
| SCHEMBL764562 | 0.56 | RAB9A (0.47) | NPC1RAB9A | |
| SCHEMBL31071537 | 0.55 | ALDH1A1 (0.30) | — | |
| SCHEMBL10287832 | 0.55 | ABL1 (0.73) | — | |
| SCHEMBL21739908 | 0.55 | SMYD3 (0.39) | CNR2SMONPC1RAB9A | |
| SCHEMBL14226166 | 0.54 | CNR2 (1.00) | CNR2NPC1RAB9A | |
| SCHEMBL31332809 | 0.53 | SLC6A4 (0.46) | GRM5NPC1RAB9A | |
| SCHEMBL27162363 | 0.53 | PDE4A (0.57) | CNR2BACE1RAB9APDE4APDE4B |
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-2011063233-A1 | AMINO HETEROARYL COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE | AMGEN INC. (US) | 2011-05-26 | — | — | WO | disclosed |