Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | STAT3 | P40763 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | TOP1 | P11387 | 6/20 | 0.37 |
| ▸ | TOP2A | P11388 | 6/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19728744 | 0.93 | TOP2A (0.44) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL19728361 | 0.91 | CYP3A4 (0.43) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL19729304 | 0.91 | STAT3 (0.40) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL19728770 | 0.90 | ALDH1A1 (0.49) | CYP3A4CYP2C9ALDH1A1TOP1TOP2A | |
| SCHEMBL20912570 | 0.89 | KDM4E (0.42) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL20912562 | 0.89 | CYP3A4 (0.42) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL19729220 | 0.89 | KDM4E (0.42) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL19728620 | 0.89 | CYP3A4 (0.41) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL20912568 | 0.88 | CYP3A4 (0.42) | KMT2ASTAT3CYP3A4CYP2C9HPGD | |
| SCHEMBL19729372 | 0.88 | STAT3 (0.38) | KMT2ASTAT3CYP3A4CYP2C9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017217441-A1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF | 湧永製薬株式会社 | 2017-12-21 | — | — | WO | disclosed |