Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL29156913 | 0.87 | ALDH1A1 (0.30) | ALDH1A1POLBKMT2ABRD4 | |
| SCHEMBL5657346 | 0.81 | BRD4 (0.46) | ALDH1A1POLBKMT2ABRD4 | |
| SCHEMBL2560497 | 0.79 | KDM4E (0.39) | ALDH1A1KMT2ABRD4 | |
| SCHEMBL2496018 | 0.77 | HPGD (0.35) | ALDH1A1POLBKMT2ABRD4 | |
| SCHEMBL9044334 | 0.76 | — | — | |
| SCHEMBL1206354 | 0.75 | — | — | |
| SCHEMBL27268233 | 0.75 | — | — | |
| SCHEMBL4103726 | 0.74 | OPRK1 (0.33) | — | |
| SCHEMBL2086433 | 0.73 | ADORA2B (0.35) | — | |
| SCHEMBL22005603 | 0.73 | KCNH2 (0.34) | TGFBR1 |
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-105793256-A | Imidazole derivatives | 豪夫迈·罗氏有限公司 | 2016-07-20 | — | — | CN | disclosed |