Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.38 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP3A43 | Q9HB55 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11046091 | 0.87 | KMT2A (0.57) | KMT2ACYP3A4LMNAHSP90AA1HDAC1 | |
| SCHEMBL11044015 | 0.85 | HSP90AA1 (0.64) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL9530582 | 0.84 | KMT2A (0.57) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL10617272 | 0.82 | KMT2A (0.55) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL10617820 | 0.80 | KMT2A (0.53) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL9530065 | 0.80 | KMT2A (0.53) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL10704140 | 0.80 | KMT2A (0.59) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL9661013 | 0.79 | KMT2A (0.86) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL9529522 | 0.79 | HSP90AA1 (0.56) | KMT2ACYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL27336382 | 0.77 | HSP90AA1 (0.83) | KMT2ACYP3A4CYP2C9CYP2C19LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0117578-A2 | Azole-substituted alcohol derivatives | SHIONOGI & CO., LTD. (JP) | 1984-09-05 | — | — | EP | disclosed |