Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.32 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5748272 | 1.00 | CYP2A6 (0.52) | CYP2A6CYP1A2AKR1C3AKR1C2TRPA1 | |
| SCHEMBL1371504 | 0.94 | CYP2A6 (0.57) | CYP2A6CYP1A2AKR1C3AKR1C2TRPA1 | |
| SCHEMBL1369929 | 0.92 | CYP2A6 (0.55) | CYP2A6CYP1A2AKR1C3AKR1C2TRPA1 | |
| SCHEMBL2258860 | 0.83 | SKP2 (0.40) | CYP2A6CYP1A2BDKRB2NPC1RAB9A | |
| SCHEMBL2252481 | 0.83 | SKP2 (0.40) | CYP2A6CYP1A2BDKRB2NPC1RAB9A | |
| SCHEMBL6885287 | 0.82 | CYP2A6 (0.73) | CYP2A6CYP1A2AKR1C3AKR1C2TRPA1 | |
| SCHEMBL6890734 | 0.82 | CYP2A6 (0.73) | CYP2A6CYP1A2AKR1C3AKR1C2TRPA1 | |
| SCHEMBL2252317 | 0.80 | ESR1 (0.41) | BDKRB2ALDH1A1LMNAHTR2AHTR2C | |
| SCHEMBL5748415 | 0.80 | ESR1 (0.41) | BDKRB2ALDH1A1LMNAHTR2AHTR2C | |
| SCHEMBL5750105 | 0.80 | ESR1 (0.41) | BDKRB2ALDH1A1LMNAHTR2AHTR2C |
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 |