Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 11/20 | 0.58 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27886004 | 0.97 | HSP90AA1 (0.59) | HSP90AA1HSP90AB1HSD17B10TRPV1NAMPT | |
| SCHEMBL27869741 | 0.89 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1TRPV1NAMPT | |
| SCHEMBL1768003 | 0.88 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1NAMPT | |
| SCHEMBL13144773 | 0.86 | HSP90AA1 (0.59) | HSP90AA1HSP90AB1NAMPT | |
| SCHEMBL13961330 | 0.86 | HSP90AA1 (0.59) | HSP90AA1HSP90AB1NAMPT | |
| SCHEMBL27869742 | 0.86 | HSP90AA1 (0.66) | HSP90AA1HSP90AB1NAMPT | |
| SCHEMBL16628727 | 0.86 | HSP90AA1 (0.71) | HSP90AA1HSP90AB1HSD17B10MEN1MAPT | |
| SCHEMBL13144926 | 0.85 | HSP90AA1 (0.57) | HSP90AA1HSP90AB1NAMPT | |
| SCHEMBL27886070 | 0.84 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1TRPV1NAMPT | |
| SCHEMBL13144929 | 0.83 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1NAMPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-102648178-A | Quinazoline derivatives | MERCK PATENT GMBH | 2012-08-22 | — | — | CN | disclosed |