Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.35 |
| ▸ | RAB9A | P51151 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | FADS1 | O60427 | 3/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | GUSB | P08236 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453931 | 0.87 | KMT2A (0.38) | LRRK2NPC1RAB9AMAPTFADS1 | |
| SCHEMBL22453483 | 0.82 | LRRK2 (0.46) | LRRK2NPC1RAB9AMAPTFADS1 | |
| SCHEMBL22453793 | 0.78 | LRRK2 (0.46) | LRRK2NPC1RAB9AMAPTFADS1 | |
| SCHEMBL22453912 | 0.78 | HDAC3 (0.37) | LRRK2NPC1RAB9AMAPTFADS1 | |
| SCHEMBL22452978 | 0.78 | LRRK2 (0.51) | LRRK2NPC1RAB9AMAPTFADS1 | |
| SCHEMBL22453391 | 0.78 | LRRK2 (0.44) | LRRK2NR1H4BRAFHDAC1 | |
| SCHEMBL22453889 | 0.75 | LRRK2 (0.42) | LRRK2NPC1RAB9AMAPTNR1H4 | |
| SCHEMBL22453892 | 0.72 | LRRK2 (0.55) | LRRK2NPC1RAB9AFADS1POLB | |
| SCHEMBL22890421 | 0.72 | LRRK2 (0.48) | LRRK2NPC1RAB9AMAPTFADS1 | |
| SCHEMBL22452996 | 0.68 | LRRK2 (0.50) | LRRK2NPC1RAB9AMAPTMEN1 |
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-2020191261-A1 | INDAZOLES AS LRRK2 INHIBITORS | E-SCAPE BIO, INC. (US) | 2020-09-24 | — | — | WO | disclosed |