Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.32 |
| ▸ | ATR | Q13535 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
| ▸ | KHK | P50053 | 1/20 | 0.30 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31216565 | 0.89 | KDM4C (0.36) | RXRARXRBRXRGKDM4CALDH1A1 | |
| SCHEMBL30162958 | 0.88 | RXRA (0.32) | RXRARXRBRXRGKDM4C | |
| SCHEMBL29218300 | 0.88 | RXRA (0.32) | RXRARXRBRXRGKDM4C | |
| SCHEMBL30162928 | 0.87 | RXRA (0.35) | RXRARXRBRXRGKDM4CALDH1A1 | |
| SCHEMBL30163167 | 0.87 | RXRA (0.33) | RXRARXRBRXRGKDM4CCYP4F2 | |
| SCHEMBL29218186 | 0.83 | BUB1 (0.35) | RXRARXRBRXRGDGAT2 | |
| SCHEMBL30162787 | 0.83 | BUB1 (0.35) | RXRARXRBRXRGDGAT2 | |
| SCHEMBL30162968 | 0.82 | RXRA (0.33) | RXRARXRBRXRGKDM4CDGAT2 | |
| SCHEMBL29218310 | 0.82 | RXRA (0.33) | RXRARXRBRXRGKDM4CDGAT2 | |
| SCHEMBL24934015 | 0.81 | BRD4 (0.34) | RXRARXRBRXRGKDM4CALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4377306-A1 | ROCK2 INHIBITORS AND USES THEREOF | President and Fellows of Harvard College (US) | 2024-06-05 | — | — | EP | disclosed |
| CN-118055926-A | ROCK2 inhibitors and uses thereof | 哈佛大学的校长及成员们 | 2024-05-17 | — | — | CN | disclosed |
| WO-2023009475-A1 | ROCK2 INHIBITORS AND USES THEREOF | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-02-02 | — | — | WO | disclosed |