Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | HBB | P68871 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 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 | |
|---|---|---|---|---|
| SCHEMBL5748504 | 0.89 | ERN1 (0.49) | ALDH1A1CYP3A4HSD17B10ALOX15CASP1 | |
| SCHEMBL342278 | 0.84 | ERN1 (0.57) | ALDH1A1CYP3A4HSD17B10HIF1ATDP1 | |
| SCHEMBL29388184 | 0.84 | ERN1 (0.57) | ALDH1A1CYP3A4HSD17B10HIF1ATDP1 | |
| SCHEMBL11298425 | 0.81 | RAB9A (0.46) | ALDH1A1CYP3A4HSD17B10ALOX15CASP1 | |
| SCHEMBL4893713 | 0.81 | ERN1 (0.50) | ALDH1A1CYP3A4HSD17B10HIF1ATDP1 | |
| SCHEMBL28218594 | 0.80 | KIF11 (0.47) | ALDH1A1HSD17B10TDP1ERN1MAPT | |
| Hydrochloric Acid SCHEMBL11298823 | 0.79 | RAB9A (0.44) | ALDH1A1CYP3A4HSD17B10ALOX15CASP1 | |
| Methyl Alcohol SCHEMBL27670101 | 0.79 | ERN1 (0.57) | ALDH1A1HSD17B10TDP1ERN1MAPT | |
| SCHEMBL16107416 | 0.79 | ALDH1A1 (0.58) | ALDH1A1CYP3A4HSD17B10ALOX15CASP1 | |
| SCHEMBL10488182 | 0.79 | CYP2A6 (0.45) | ALDH1A1TDP1ERN1MAPTRAB9A |
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 |