Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.58 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.48 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.48 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23565002 | 0.79 | KMT2A (0.66) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL9431727 | 0.77 | KMT2A (0.63) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL10692807 | 0.77 | KMT2A (0.68) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL16082991 | 0.77 | ALDH1A1 (0.83) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL4035227 | 0.77 | KMT2A (0.68) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL11294213 | 0.77 | KMT2A (0.58) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL31248356 | 0.75 | CYP2C9 (0.67) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL1709315 | 0.75 | HPGD (0.70) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL4586604 | 0.75 | KMT2A (0.66) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL7932170 | 0.75 | KMT2A (0.66) | KMT2AMEN1CYP2C9CYP2C19ALDH1A1 |
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-2604260-A1 | NOVEL HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | Shionogi&Co., Ltd. (JP) | 2013-06-19 | — | — | EP | disclosed |