Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9797581 | 0.88 | CYP2A6 (0.41) | CYP2A6ALDH1A1HSD17B10KDM4EPTGS2 | |
| SCHEMBL2820496 | 0.80 | CYP3A4 (0.48) | TYMSALDH1A1CYP3A4HSD17B10MPO | |
| SCHEMBL31040467 | 0.80 | CYP3A4 (0.48) | TYMSALDH1A1CYP3A4HSD17B10MPO | |
| SCHEMBL3735918 | 0.79 | ALDH1A1 (0.52) | CYP2A6ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL29590945 | 0.79 | ALDH1A1 (0.52) | CYP2A6ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL5748274 | 0.78 | ERBB2 (0.36) | CYP2A6ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL29957342 | 0.77 | ALDH1A1 (0.50) | CYP2A6ALDH1A1CYP3A4HSD17B10ALOX15 | |
| SCHEMBL2346924 | 0.77 | ALDH1A1 (0.50) | CYP2A6ALDH1A1CYP3A4HSD17B10ALOX15 | |
| SCHEMBL9099739 | 0.76 | ALDH1A1 (0.48) | CYP2A6ALDH1A1CYP3A4HSD17B10ALOX15 | |
| SCHEMBL29954379 | 0.76 | ALDH1A1 (0.48) | CYP2A6ALDH1A1CYP3A4HSD17B10ALOX15 |
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 |