Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 3/20 | 0.34 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25520053 | 0.93 | ESR1 (0.43) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL27033294 | 0.81 | MAOB (0.33) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL27033314 | 0.81 | MAPT (0.34) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL31538921 | 0.81 | MAPT (0.34) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL30726161 | 0.81 | MAOB (0.33) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL25521798 | 0.80 | MAOB (0.41) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL25522337 | 0.78 | DHODH (0.38) | ESR1ESR2MEN1KMT2A | |
| SCHEMBL25522343 | 0.77 | ESR1 (0.38) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL11088632 | 0.76 | ESR2 (0.51) | ESR1ESR2BACE1MAOBMAOA | |
| SCHEMBL25521681 | 0.75 | AR (0.54) | ESR1ESR2KDM4EMEN1KMT2A |
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 |