Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 3/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.31 |
| ▸ | KLKB1 | P03952 | 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 | |
|---|---|---|---|---|
| SCHEMBL8803908 | 0.94 | ALDH1A1 (0.40) | PIM1CYP19A1KDM4EALDH1A1POLB | |
| SCHEMBL8801565 | 0.89 | PIM1 (0.47) | PIM1CYP19A1KDM4EALDH1A1POLB | |
| SCHEMBL8802774 | 0.86 | CYP3A4 (0.36) | PIM1CYP19A1KDM4EALDH1A1POLB | |
| SCHEMBL8801865 | 0.86 | CYP19A1 (0.38) | CYP19A1KDM4EALDH1A1IDO1TDO2 | |
| SCHEMBL8801306 | 0.85 | PIM1 (0.37) | PIM1CYP19A1KDM4EALDH1A1POLB | |
| SCHEMBL8802022 | 0.84 | CYP3A4 (0.35) | CYP19A1KDM4EALDH1A1POLBHSP90AA1 | |
| SCHEMBL8801505 | 0.84 | HPGD (0.42) | CYP19A1KDM4EALDH1A1POLBHSP90AA1 | |
| SCHEMBL8803705 | 0.84 | HDAC1 (0.38) | PIM1CYP19A1KDM4EALDH1A1POLB | |
| SCHEMBL8803902 | 0.82 | ALDH1A1 (0.52) | PIM1CYP19A1KDM4EALDH1A1POLB | |
| SCHEMBL9048087 | 0.81 | KDM4E (0.41) | PIM1KDM4EALDH1A1POLBHSP90AA1 |
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-0612731-B1 | Novel guinolone and naphthyridone derivatives | BAYER AG (DE) | 1997-08-20 | — | — | EP | disclosed |
| EP-0612731-A1 | Novel guinolone and naphthyridone derivatives | BAYER AG (DE) | 1994-08-31 | — | — | EP | disclosed |