Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.32 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL11256928 | 0.86 | TSHR (0.43) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11249211 | 0.85 | CYP19A1 (0.40) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11250364 | 0.83 | CYP19A1 (0.47) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11239589 | 0.82 | CYP3A4 (0.46) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11255691 | 0.81 | CYP19A1 (0.42) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11286839 | 0.75 | CYP19A1 (0.37) | CYP3A4CYP19A1NPSR1MEN1ALDH1A1 | |
| SCHEMBL11251144 | 0.74 | CYP19A1 (0.47) | CYP3A4TSHRMAPK1CYP19A1NPSR1 | |
| SCHEMBL11261677 | 0.71 | TSHR (0.43) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11571703 | 0.71 | TSHR (0.47) | CYP3A4TSHRMAPK1TDP1CYP19A1 | |
| SCHEMBL11870624 | 0.71 | TSHR (0.55) | CYP3A4TSHRMAPK1TDP1CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4322442-A | INSECTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1982-03-30 | — | — | US | disclosed |