Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8202857 | 0.91 | CYP19A1 (0.34) | CYP19A1MTNR1AMTNR1B | |
| SCHEMBL8196011 | 0.89 | CYP19A1 (0.34) | CYP19A1MTNR1AMTNR1B | |
| SCHEMBL8202811 | 0.88 | CYP19A1 (0.35) | CYP19A1MTNR1AMTNR1B | |
| SCHEMBL3284276 | 0.79 | CYP19A1 (0.34) | CYP19A1MTNR1AMTNR1BKDM4EALDH1A1 | |
| SCHEMBL3280434 | 0.79 | CYP19A1 (0.35) | CYP19A1MTNR1AMTNR1BKDM4EALDH1A1 | |
| SCHEMBL3279500 | 0.78 | CYP19A1 (0.33) | CYP19A1MTNR1AMTNR1B | |
| SCHEMBL3280349 | 0.76 | MTNR1A (0.34) | CYP19A1MTNR1AMTNR1B | |
| SCHEMBL8203579 | 0.76 | MTNR1A (0.38) | CYP19A1MTNR1AMTNR1BKDM4E | |
| SCHEMBL8208702 | 0.75 | MTNR1A (0.38) | CYP19A1MTNR1AMTNR1BKDM4E | |
| SCHEMBL4507171 | 0.70 | MDM2 (0.34) | MTNR1AMTNR1B |
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-2008043698-A1 | VINYLOGOUS ACIDS DERIVATIVES AS CHYMASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-04-17 | — | — | WO | disclosed |