Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | STAT1 | P42224 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SLC26A6 | Q9BXS9 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20154223 | 0.85 | KMT2A (0.50) | RAB9AMAPTSTAT1NPSR1POLB | |
| SCHEMBL21332793 | 0.82 | SLC26A6 (0.46) | RAB9ANPSR1POLBNPC1KMT2A | |
| SCHEMBL21743139 | 0.82 | TDP1 (0.47) | RAB9AMAPTSTAT1NPSR1POLB | |
| SCHEMBL2779491 | 0.81 | CYP1A2 (0.41) | RAB9AMAPTNPSR1POLBNPC1 | |
| SCHEMBL22950031 | 0.78 | RAB9A (0.50) | RAB9AMAPTSTAT1NPSR1NPC1 | |
| SCHEMBL20154268 | 0.76 | TDP1 (0.58) | RAB9AMAPTSTAT1NPSR1POLB | |
| SCHEMBL22005649 | 0.73 | TDP1 (0.51) | RAB9AMAPTSTAT1NPSR1POLB | |
| SCHEMBL19975800 | 0.73 | TDP1 (0.54) | RAB9AMAPTNPC1KMT2ATDP1 | |
| SCHEMBL26381487 | 0.73 | RAB9A (0.49) | RAB9AMAPTSTAT1NPSR1POLB | |
| SCHEMBL20154180 | 0.73 | HTT (0.57) | RAB9AMAPTNPC1KMT2ATDP1 |
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-2018059314-A1 | AZABICYCLE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2018-04-05 | — | — | WO | disclosed |