Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22445781 | 0.88 | SMN1; SMN2 (0.49) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL9523494 | 0.87 | ALDH1A1 (0.53) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL22453986 | 0.82 | KDM4E (0.46) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL7362801 | 0.79 | POLB (0.60) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL1296287 | 0.78 | CYP3A4 (0.56) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL3277897 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL13934247 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL22453926 | 0.76 | SMN1; SMN2 (0.52) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL1085394 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 | |
| SCHEMBL4253373 | 0.75 | POLB (0.49) | SMN1; SMN2CYP3A4TDP1KDM4EALDH1A1 |
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 |