Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 2/20 | 0.34 |
| ▸ | GCGR | P47871 | 3/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | P4HB | P07237 | 1/20 | 0.31 |
| ▸ | PRKCI | P41743 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25520062 | 0.84 | CYP11B1 (0.45) | CYP11B1CYP11B2CYP17A1CYP3A4KDM4E | |
| SCHEMBL25522204 | 0.81 | RPS6KA3 (0.46) | CYP11B1CYP11B2CYP17A1CYP3A4KDM4E | |
| SCHEMBL25523901 | 0.81 | ERN1 (0.37) | CYP11B1CYP11B2CYP17A1CYP3A4KDM4E | |
| SCHEMBL25522049 | 0.80 | SLC22A12 (0.38) | CYP11B1CYP11B2CYP17A1CYP3A4RPS6KA3 | |
| SCHEMBL25522051 | 0.80 | RPS6KA3 (0.42) | KDM4ERPS6KA3PRKCI | |
| SCHEMBL25522050 | 0.74 | RPS6KA3 (0.41) | KDM4ERPS6KA3AKT1MAPK10 | |
| SCHEMBL25523903 | 0.72 | KDM4E (0.40) | KDM4E | |
| SCHEMBL25522351 | 0.71 | CYP17A1 (0.41) | CYP11B1CYP11B2CYP17A1CYP3A4KDM4E | |
| SCHEMBL25521800 | 0.70 | AAK1 (0.47) | — | |
| SCHEMBL25524102 | 0.69 | ABCG2 (0.47) | KDM4EGCGR |
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 |