Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 10/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.35 |
| ▸ | IL1B | P01584 | 1/20 | 0.35 |
| ▸ | MPI | P34949 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25523415 | 0.94 | ERN1 (0.42) | ERN1AKR1C3AKR1C2METKDM4E | |
| SCHEMBL25523901 | 0.81 | ERN1 (0.37) | ERN1AKR1C3AKR1C2METKDM4E | |
| SCHEMBL25522332 | 0.79 | ERN1 (0.43) | ERN1METKDM4EMAPTIL1B | |
| SCHEMBL25522204 | 0.78 | RPS6KA3 (0.46) | ERN1KDM4ERPS6KA3CYP17A1CYP3A4 | |
| SCHEMBL25523417 | 0.78 | KDM4E (0.42) | KDM4EMAPTRPS6KA3MPIL3MBTL1 | |
| SCHEMBL25521555 | 0.77 | ERN1 (0.50) | ERN1KDM4EMAPT | |
| SCHEMBL12343890 | 0.74 | MET (0.49) | MET | |
| SCHEMBL25521416 | 0.73 | AKR1C3 (0.45) | AKR1C3AKR1C2METKDM4E | |
| SCHEMBL25523411 | 0.72 | AAK1 (0.44) | — | |
| SCHEMBL25522331 | 0.72 | L3MBTL1 (0.50) | METKDM4EMPIL3MBTL1 |
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 |