Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | AMY1A | P0DUB6 | 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 | |
|---|---|---|---|---|
| SCHEMBL9797581 | 0.79 | CYP2A6 (0.41) | CYP2A6ALDH1A1TSHRHSD17B10AMY1A | |
| SCHEMBL30745195 | 0.78 | CYP1A2 (0.42) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL5748718 | 0.78 | CYP2A6 (0.35) | CYP2A6ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL6339008 | 0.78 | CYP1A2 (0.42) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL28058258 | 0.78 | KDM4E (0.44) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL30989489 | 0.78 | KDM4E (0.44) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL5747909 | 0.77 | CCR1 (0.35) | CYP1A2ALDH1A1CYP3A4HPGDTDP1 | |
| SCHEMBL5749869 | 0.77 | CCR1 (0.35) | CYP1A2ALDH1A1CYP3A4HPGDTDP1 | |
| SCHEMBL29372072 | 0.77 | KEAP1 (0.42) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL867279 | 0.77 | KEAP1 (0.42) | ERBB2CYP1A2FYNMAOAACHE |
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 |