Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TOP1 | P11387 | 3/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | TOP2A | P11388 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8178742 | 0.88 | PIM1 (0.42) | CYP3A4CYP2C9KDM4EALDH1A1POLB | |
| Methylamine SCHEMBL7006667 | 0.86 | PIM1 (0.43) | CYP3A4CYP2C9KDM4EALDH1A1POLB | |
| SCHEMBL7015797 | 0.80 | TOP1 (0.41) | ALDH1A1POLBSTAT3PIM1TOP1 | |
| SCHEMBL7009626 | 0.79 | TOP1 (0.47) | CYP3A4CYP2C9KDM4EALDH1A1POLB | |
| SCHEMBL7012609 | 0.78 | PIM1 (0.42) | CYP3A4CYP2C9KDM4EALDH1A1POLB | |
| SCHEMBL7008042 | 0.78 | PIM1 (0.41) | CYP3A4CYP2C9KDM4EALDH1A1POLB | |
| SCHEMBL7010755 | 0.77 | PIM1 (0.46) | CYP3A4CYP2C9KDM4EALDH1A1POLB | |
| SCHEMBL7008534 | 0.77 | TOP1 (0.42) | KDM4EALDH1A1POLBHSP90AA1RXFP1 | |
| SCHEMBL7004407 | 0.75 | PIM1 (0.42) | KDM4EALDH1A1POLBHSP90AA1RXFP1 | |
| SCHEMBL7007323 | 0.74 | PIM1 (0.38) | CYP3A4CYP2C9KDM4EALDH1A1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0945435-B1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | WAKUNAGA PHARMA CO LTD (JP) | 2003-08-13 | — | — | EP | disclosed |
| EP-0945435-A1 | NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) | 1999-09-29 | — | — | EP | disclosed |