Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | HBB | P68871 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | NQO1 | P15559 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5748666 | 1.00 | ALDH1A1 (0.55) | ALDH1A1HSD17B10CYP3A4TDP1ALOX15 | |
| SCHEMBL229214 | 0.86 | PLAU (0.53) | ALDH1A1HSD17B10CYP3A4TDP1ALOX15 | |
| SCHEMBL1114836 | 0.86 | CTDSP1 (0.53) | ALDH1A1HSD17B10CYP3A4TDP1ALOX15 | |
| SCHEMBL27591283 | 0.86 | NQO1 (0.69) | ALDH1A1HSD17B10NQO1KDM4EHPGD | |
| SCHEMBL1311502 | 0.86 | NQO1 (0.69) | ALDH1A1HSD17B10NQO1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL1114720 | 0.84 | PLAU (0.52) | ALDH1A1HSD17B10CYP3A4TDP1ALOX15 | |
| Hydrochloric Acid SCHEMBL1114622 | 0.84 | CTDSP1 (0.52) | ALDH1A1HSD17B10CYP3A4TDP1ALOX15 | |
| SCHEMBL1003225 | 0.84 | NQO1 (0.72) | ALDH1A1HSD17B10NQO1KDM4EHPGD | |
| SCHEMBL30949381 | 0.84 | NQO1 (0.72) | ALDH1A1HSD17B10NQO1KDM4EHPGD | |
| SCHEMBL6939973 | 0.83 | CYP1A2 (0.57) | ALDH1A1HSD17B10CYP3A4NQO1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-20060293503-A1 | Polyaminopyridines and method for producing same | SUMITOMO SEIKA CHEMICALS CO., LTD (JP) | 2006-12-28 | — | — | US | disclosed |
| EP-1669390-A1 | POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 2006-06-14 | — | — | EP | disclosed |