Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL2177010 | 0.82 | MAPT (0.33) | — | |
| SCHEMBL5167373 | 0.77 | THRB (0.31) | — | |
| SCHEMBL1249464 | 0.76 | PDE2A (0.32) | — | |
| SCHEMBL27875777 | 0.73 | KDM4E (0.42) | BCHEACHEPTGS2 | |
| SCHEMBL23944802 | 0.71 | MMP8 (0.42) | — | |
| SCHEMBL22688372 | 0.70 | THRB (0.36) | — | |
| SCHEMBL5421643 | 0.69 | — | — | |
| SCHEMBL10441525 | 0.67 | SELL (0.33) | PTGS2 | |
| SCHEMBL8077990 | 0.67 | SELL (0.33) | PTGS2 | |
| SCHEMBL25616250 | 0.67 | MMP8 (0.40) | — |
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-2017216280-A1 | TETRAHYDRO-PYRIDO[3,4-b]INDOLE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2017-12-21 | — | — | WO | disclosed |