Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 20/20 | 0.47 |
| ▸ | TTK | P33981 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24786918 | 0.91 | PRKDC (0.47) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL23618691 | 0.91 | PRKDC (0.47) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL23618742 | 0.90 | PRKDC (0.46) | PRKDCTTKKCNH2CSF1R | |
| SCHEMBL23618674 | 0.89 | PRKDC (0.48) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL30237167 | 0.89 | PRKDC (0.48) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL23618703 | 0.88 | PRKDC (0.45) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL23618813 | 0.88 | PRKDC (0.44) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL23618776 | 0.86 | PRKDC (0.46) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL30236876 | 0.86 | PRKDC (0.46) | PRKDCTTKKCNH2PIK3CAATM | |
| SCHEMBL23618777 | 0.85 | PRKDC (0.42) | PRKDCTTKKCNH2PIK3CAATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-4086258-A1 | PURINE DERIVATIVE AND MEDICAL USE THEREOF | Chengdu Baiyu Pharmaceutical Co., Ltd. (CN) | 2022-11-09 | — | — | EP | disclosed |