Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 2/20 | 0.34 |
| ▸ | FLT4 | P35916 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | FNTA | P49354 | 1/20 | 0.30 |
| ▸ | FNTB | P49356 | 1/20 | 0.30 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8697944 | 0.91 | CYP3A4 (0.43) | CYP3A4CYP3A5FLT1FLT4KDR | |
| SCHEMBL8698526 | 0.85 | CYP3A4 (0.38) | CYP3A4CYP3A5FLT1FLT4KDR | |
| SCHEMBL8698474 | 0.85 | CYP19A1 (0.38) | CYP3A4CYP3A5MAPKAPK2CYP11B2KIF11 | |
| SCHEMBL8698505 | 0.80 | CYP19A1 (0.38) | CYP3A4CYP3A5CYP19A1TSHR | |
| SCHEMBL8697496 | 0.79 | AR (0.41) | CYP3A4CYP3A5CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL8697489 | 0.79 | CYP3A4 (0.49) | CYP3A4CYP3A5FLT1FLT4KDR | |
| SCHEMBL8698611 | 0.78 | CYP19A1 (0.41) | CYP3A4CYP11B1CYP11B2CYP19A1 | |
| SCHEMBL8702192 | 0.77 | CYP19A1 (0.41) | CYP3A4CYP19A1CYP2D6TSHRCYP2C19 | |
| SCHEMBL8700497 | 0.73 | CYP19A1 (0.43) | CYP3A4CYP3A5CYP11B2CYP19A1FNTA | |
| SCHEMBL8697579 | 0.73 | CYP19A1 (0.51) | MAPKAPK2CYP19A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998018791-A1 | HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS | A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) | 1998-05-07 | — | — | WO | claimed |
| WO-1998018791-A1 | HETEROCYCLIC FURAN COMPOUNDS, THEIR PREPARATION AND USE AS AROMATASE INHIBITORS | A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) | 1998-05-07 | — | — | WO | disclosed |