Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | F12 | P00748 | 1/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 9/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31510265 | 0.89 | ADORA1 (0.42) | ADORA1ESR2NR1H2MAPTKDM4E | |
| SCHEMBL15208166 | 0.83 | ESR2 (0.49) | ADORA1ESR2NR1H2MAPTKDM4E | |
| SCHEMBL15730073 | 0.80 | DPP4 (0.47) | ADORA1ESR2NR1H2MAPTKDM4E | |
| SCHEMBL14863231 | 0.80 | ADORA1 (0.42) | ADORA1ESR2NR1H2MAPTP2RX3 | |
| SCHEMBL31510242 | 0.80 | SLC26A4 (0.49) | ESR2MAPTKDM4EP2RX3 | |
| SCHEMBL18618369 | 0.79 | UCHL1 (0.42) | ADORA1ESR2NR1H2MAPTKDM4E | |
| SCHEMBL17317618 | 0.78 | KCNK3 (0.45) | P2RX3 | |
| SCHEMBL15332697 | 0.75 | ESR2 (0.43) | ADORA1ESR2NR1H2MAPTF12 | |
| SCHEMBL17328077 | 0.75 | ADORA1 (0.43) | ADORA1ESR2NR1H2MAPTKDM4E | |
| SCHEMBL22716585 | 0.75 | NR1H2 (0.39) | ESR2NR1H2MAPTF12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025051129-A1 | ARYL HETEROCYCLIC SLC7A11 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海深势唯思科技有限责任公司 | 2025-03-13 | — | — | WO | disclosed |
| CN-119552124-A | Aryl heterocycle SLC7A11 inhibitor and preparation method and application thereof | 上海深势唯思科技有限责任公司 | 2025-03-04 | — | — | CN | disclosed |