Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.42 |
| ▸ | BRAF | P15056 | 8/20 | 0.42 |
| ▸ | RAF1 | P04049 | 1/20 | 0.42 |
| ▸ | ARAF | P10398 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.40 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453391 | 0.84 | LRRK2 (0.44) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22452944 | 0.84 | LRRK2 (0.44) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22452996 | 0.80 | LRRK2 (0.50) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22453889 | 0.75 | LRRK2 (0.42) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22453892 | 0.74 | LRRK2 (0.55) | LRRK2HDAC1HDAC8HDAC6PKM | |
| SCHEMBL22453429 | 0.70 | LRRK2 (0.42) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22452969 | 0.70 | LRRK2 (0.48) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22453384 | 0.69 | LRRK2 (0.50) | LRRK2HDAC1BRAFRAF1ARAF | |
| SCHEMBL22454017 | 0.68 | TSHR (0.39) | KMT2AMEN1LMNAPOLBAPEX1 | |
| SCHEMBL8980367 | 0.67 | KMT2A (0.60) | HDAC1BRAFHDAC3HDAC4HDAC7 |
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 |