Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | CASP1 | P29466 | 2/20 | 0.56 |
| ▸ | CASP7 | P55210 | 2/20 | 0.56 |
| ▸ | HBB | P68871 | 2/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 8/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.41 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5750008 | 1.00 | CYP1A2 (0.57) | CYP1A2CYP2A6ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL12920886 | 0.96 | CYP1A2 (0.61) | CYP1A2CYP2A6ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL12825375 | 0.94 | CYP1A2 (0.59) | CYP1A2CYP2A6ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL6890734 | 0.87 | CYP2A6 (0.73) | CYP1A2CYP2A6ALDH1A1MEN1KMT2A | |
| SCHEMBL6885287 | 0.87 | CYP2A6 (0.73) | CYP1A2CYP2A6ALDH1A1MEN1KMT2A | |
| SCHEMBL5421465 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2A6ALDH1A1HSD17B10MEN1 | |
| SCHEMBL347592 | 0.82 | CYP2A6 (0.80) | CYP1A2CYP2A6ALDH1A1MAPTAKR1C3 | |
| SCHEMBL29407167 | 0.82 | CYP2A6 (0.80) | CYP1A2CYP2A6ALDH1A1MAPTAKR1C3 | |
| SCHEMBL40950 | 0.80 | CYP1A2 (0.86) | CYP1A2CYP2A6ALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL6890420 | 0.80 | CYP1A2 (0.86) | CYP1A2CYP2A6ALDH1A1HSD17B10CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3790875-B1 | N-HETEROARYLENE COMPOUNDS WITH LOW LUMO ENERGIES | NOVALED GMBH (DE) | 2024-07-03 | — | — | EP | disclosed |
| 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 |