Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 7/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25522334 | 0.81 | KDM4E (0.35) | KDM4EGRIN2B | |
| SCHEMBL25522210 | 0.80 | KDM4E (0.42) | KDM4EPARP1NR1H2NR1H3GRIN2B | |
| SCHEMBL25522347 | 0.79 | KDM4E (0.48) | KDM4EL3MBTL1NPC1RAB9A | |
| SCHEMBL25520063 | 0.76 | KDM4E (0.46) | KDM4EPARP1NR1H2NR1H3L3MBTL1 | |
| SCHEMBL25521932 | 0.74 | KDM4E (0.49) | KDM4EPARP1NR1H2NR1H3L3MBTL1 | |
| SCHEMBL25522344 | 0.73 | CASR (0.36) | HSD17B1HSD17B2 | |
| SCHEMBL26563578 | 0.73 | PARP1 (0.43) | KDM4EPARP1NR1H2NR1H3 | |
| SCHEMBL25522431 | 0.70 | ESR1 (0.39) | L3MBTL1 | |
| SCHEMBL25522349 | 0.69 | ESR1 (0.36) | KDM4EL3MBTL1CYP11B2HSD17B1HSD17B2 | |
| SCHEMBL24987024 | 0.67 | PARP1 (0.55) | KDM4EPARP1NR1H2NR1H3GRIN2B |
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-2023086428-A2 | NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF | ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) | 2023-05-19 | — | — | WO | disclosed |