Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | HBB | P68871 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | EP300 | Q09472 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL535685 | 0.85 | NQO1 (0.50) | NQO1ALDH1A1CYP3A4HSD17B10TDP1 | |
| Hydrochloric Acid SCHEMBL22445135 | 0.83 | EP300 (0.48) | NQO1ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL2764307 | 0.81 | NQO1 (0.61) | NQO1ALDH1A1CYP3A4HSD17B10MAPT | |
| SCHEMBL29861922 | 0.81 | NQO1 (0.61) | NQO1ALDH1A1CYP3A4HSD17B10MAPT | |
| Naphthylamine SCHEMBL7136311 | 0.81 | ALDH1A1 (0.57) | NQO1ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL27996593 | 0.79 | NQO1 (0.59) | NQO1ALDH1A1CYP3A4HSD17B10MAPT | |
| SCHEMBL5748666 | 0.77 | ALDH1A1 (0.55) | NQO1ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL5746728 | 0.77 | ALDH1A1 (0.55) | NQO1ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL11312377 | 0.77 | ALDH1A1 (0.60) | NQO1ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL30949381 | 0.76 | NQO1 (0.72) | NQO1ALDH1A1HSD17B10MAPTKDM4E |
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 |