Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.70 |
| ▸ | HPGD | P15428 | 6/20 | 0.66 |
| ▸ | POLB | P06746 | 5/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.66 |
| ▸ | MAPT | P10636 | 1/20 | 0.66 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.66 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.57 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL29410065 | 0.89 | ALDH1A1 (0.74) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL9912447 | 0.85 | ALDH1A1 (0.70) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL6070205 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL2638805 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL2638802 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL20189300 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL14511323 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL6029533 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL19726938 | 0.84 | HPGD (0.73) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 | |
| SCHEMBL6360360 | 0.84 | ALDH1A1 (0.68) | ALDH1A1HPGDPOLBL3MBTL1HSD17B10 |
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-6867200-B1 | (Hetero)aryl-bicyclic heteroaryl derivatives, their preparation and their use as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-15 | — | — | US | disclosed |