Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.68 |
| ▸ | RAB9A | P51151 | 5/20 | 0.68 |
| ▸ | FAAH | O00519 | 4/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | KLF5 | Q13887 | 2/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.56 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | NAMPT | P43490 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | MMP13 | P45452 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL5039674 | 0.87 | NPC1 (0.68) | NPC1RAB9AFAAHKMT2AKLF5 | |
| SCHEMBL5045742 | 0.85 | NPC1 (0.65) | NPC1RAB9AFAAHKMT2AKLF5 | |
| SCHEMBL1858952 | 0.85 | NPC1 (0.62) | NPC1RAB9AFAAHKMT2AKLF5 | |
| SCHEMBL11717444 | 0.84 | NPC1 (0.76) | NPC1RAB9AFAAHKMT2AKLF5 | |
| SCHEMBL17822164 | 0.81 | NPC1 (1.00) | NPC1RAB9AKMT2AKLF5PKM | |
| SCHEMBL30666147 | 0.81 | NPC1 (1.00) | NPC1RAB9AKMT2AKLF5PKM | |
| SCHEMBL3224873 | 0.81 | NPC1 (0.64) | NPC1RAB9AFAAHKMT2AKLF5 | |
| SCHEMBL5043725 | 0.80 | RAB9A (0.58) | NPC1RAB9AFAAHKMT2AKLF5 | |
| SCHEMBL5943980 | 0.79 | AURKA (0.56) | FAAHKMT2AHSP90AA1TDP1LMNA | |
| SCHEMBL107323 | 0.79 | RAB9A (0.81) | NPC1RAB9AKMT2AKLF5PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-1732534-B1 | USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS | SERONO LAB (CH) | 2008-07-23 | — | — | EP | claimed |