Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.41 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16955449 | 0.86 | NQO1 (0.50) | NQO1TDP1TSHRLTA4HMAPT | |
| SCHEMBL16958794 | 0.84 | TSHR (0.40) | TDP1TSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL13570675 | 0.81 | DHFR (0.43) | NQO1FGFR1FGFR2KAT6AGAA | |
| SCHEMBL16961444 | 0.81 | FFAR4 (0.40) | TSHRCYP2D6CYP2C19MAOBMAPT | |
| SCHEMBL1680217 | 0.80 | NQO1 (0.50) | NQO1FGFR1FGFR2KAT6ATDP1 | |
| SCHEMBL5671801 | 0.80 | NQO1 (0.50) | NQO1FGFR1FGFR2KAT6ATDP1 | |
| SCHEMBL16951572 | 0.79 | NQO1 (0.43) | NQO1KAT6ATDP1TSHRLTA4H | |
| SCHEMBL16954496 | 0.79 | ESR1 (0.50) | NQO1KAT6ATDP1TSHRCYP1A2 | |
| SCHEMBL16959395 | 0.79 | CHRNB2 (0.30) | — | |
| SCHEMBL16956441 | 0.79 | ALDH1A1 (0.41) | FGFR1FGFR2GAASYKALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |