Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLKL | Q8NB16 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14738347 | 0.88 | L3MBTL1 (0.39) | ALDH1A1SMN1; SMN2POLBLMNAL3MBTL1 | |
| SCHEMBL14738723 | 0.78 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2GAAMAPTLMNA | |
| SCHEMBL14753496 | 0.73 | RHEB (0.39) | ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL7716031 | 0.71 | ALOX12 (0.38) | ALDH1A1SMN1; SMN2POLBLMNAHTT | |
| SCHEMBL7713034 | 0.66 | RAB9A (0.43) | ALDH1A1SMN1; SMN2GAAMAPTLMNA | |
| SCHEMBL14753466 | 0.66 | CCNB2 (0.42) | ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL8326413 | 0.65 | AURKA (0.42) | ALDH1A1SMN1; SMN2MAPTHTTL3MBTL1 | |
| SCHEMBL7710506 | 0.65 | RHEB (0.40) | ALDH1A1RXFP1L3MBTL1NPC1 | |
| SCHEMBL29286701 | 0.64 | AXL (0.46) | ALDH1A1SMN1; SMN2GAA | |
| SCHEMBL2594688 | 0.64 | SLC6A4 (0.43) | ALDH1A1 |
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-2011140164-A1 | AZA-INDOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH | MERCK SHARP & DOHME CORP. (US) | 2011-11-10 | — | — | WO | disclosed |