Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 7/20 | 0.44 |
| ▸ | ESR1 | P03372 | 4/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | P4HB | P07237 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25520068 | 0.96 | RPS6KA3 (0.45) | RPS6KA3ESR1ESR2CYP17A1KDM4E | |
| SCHEMBL25522050 | 0.83 | RPS6KA3 (0.41) | RPS6KA3ESR1ESR2KDM4ENPC1 | |
| SCHEMBL25522348 | 0.77 | FEN1 (0.36) | ESR1ESR2 | |
| SCHEMBL25522204 | 0.77 | RPS6KA3 (0.46) | RPS6KA3CYP17A1KDM4ECYP3A4CYP11B1 | |
| SCHEMBL25522349 | 0.76 | ESR1 (0.36) | RPS6KA3ESR1ESR2CYP17A1KDM4E | |
| SCHEMBL25105588 | 0.73 | MAOA (0.39) | RPS6KA3KDM4EMAOA | |
| SCHEMBL25521659 | 0.73 | RPS6KA3 (0.47) | RPS6KA3ESR1ESR2 | |
| SCHEMBL25522331 | 0.73 | L3MBTL1 (0.50) | KDM4ENPC1RAB9AL3MBTL1 | |
| SCHEMBL25522440 | 0.73 | FEN1 (0.37) | ESR1ESR2 | |
| SCHEMBL25092530 | 0.72 | RPS6KA3 (0.35) | RPS6KA3 |
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 |