Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.58 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.58 |
| ▸ | TOP1 | P11387 | 3/20 | 0.53 |
| ▸ | STAT3 | P40763 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TOP2A | P11388 | 9/20 | 0.44 |
| ▸ | TOP2B | Q02880 | 8/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9047182 | 0.90 | ALDH1A1 (0.64) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL6214789 | 0.83 | KDM4E (0.65) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL31435135 | 0.82 | ALDH1A1 (0.64) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL6220162 | 0.82 | ALDH1A1 (0.64) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL9869652 | 0.81 | ALDH1A1 (0.63) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL10635691 | 0.81 | ALDH1A1 (0.63) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL6213800 | 0.80 | ALDH1A1 (0.67) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL7009143 | 0.79 | TOP1 (0.57) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL9869480 | 0.79 | ALDH1A1 (0.72) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 | |
| SCHEMBL10372132 | 0.79 | ALDH1A1 (0.65) | ALDH1A1KDM4EPOLBHSP90AA1RXFP1 |
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-0500835-B1 | A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE | DAE WOONG PHARMA (KR) | 1996-12-27 | — | — | EP | disclosed |