Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MC5R | P33032 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MC1R | Q01726 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21379748 | 0.80 | HPGD (0.63) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL30380729 | 0.79 | HPGD (0.62) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL20495652 | 0.78 | HPGD (0.66) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL29646511 | 0.78 | HPGD (0.66) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL20495649 | 0.78 | HPGD (0.69) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL29582547 | 0.78 | HPGD (0.69) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| Hydrochloric Acid SCHEMBL3472372 | 0.77 | HPGD (0.64) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL27782912 | 0.76 | POLB (0.47) | HPGDCA2KMT2AALDH1A1MAPT | |
| SCHEMBL5870612 | 0.76 | CA2 (0.63) | HPGDL3MBTL1MC5RMAPK1MC1R | |
| SCHEMBL11934975 | 0.76 | CA2 (0.59) | HPGDL3MBTL1MC5RMAPK1MC1R |
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-6544982-B1 | 3-aryl-5-aminoisoxazole derivatives | MERCK & CO., INC. | 2003-04-08 | — | — | US | disclosed |