Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.53 |
| ▸ | LRRK2 | Q5S007 | 9/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.47 |
| ▸ | GHSR | Q92847 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15701018 | 0.77 | NPC1 (0.55) | RAB9ANPC1HTTMAPTOPRK1 | |
| SCHEMBL30689707 | 0.76 | MAPK14 (0.50) | MAPK14 | |
| SCHEMBL16365880 | 0.74 | CHEK1 (0.65) | LRRK2RAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL15701277 | 0.74 | NPC1 (0.64) | RAB9ANPC1MAPTPOLBSMN1; SMN2 | |
| SCHEMBL2186169 | 0.74 | CSNK1E (0.53) | LRRK2RAB9ANPC1HTTMAPT | |
| SCHEMBL19270379 | 0.73 | RAB9A (0.50) | RAB9ANPC1HTTMAPTOPRK1 | |
| SCHEMBL25809876 | 0.71 | APP (0.50) | RAB9ANPC1MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL25646012 | 0.71 | LRRK2 (0.63) | LRRK2RAB9ANPC1HTTMAPT | |
| SCHEMBL31472503 | 0.71 | LRRK2 (0.63) | LRRK2RAB9ANPC1HTTMAPT | |
| SCHEMBL25809873 | 0.71 | ALDH1A1 (0.52) | LRRK2RAB9ANPC1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-7601745-B2 | Heterocyclic NF-kB inhibitors | 4SC AG (DE) | 2009-10-13 | — | — | US | disclosed |