Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 12/20 | 0.38 |
| ▸ | CA12 | O43570 | 11/20 | 0.38 |
| ▸ | CA1 | P00915 | 11/20 | 0.38 |
| ▸ | CA9 | Q16790 | 11/20 | 0.38 |
| ▸ | CA5A | P35218 | 4/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.38 |
| ▸ | CA4 | P22748 | 3/20 | 0.38 |
| ▸ | CA6 | P23280 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 3/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8560405 | 0.85 | NT5E (0.43) | CA2CA12CA1CA9ALDH1A1 | |
| SCHEMBL8566803 | 0.78 | ALOX15 (0.44) | CA2CA12CA1CA9ALDH1A1 | |
| SCHEMBL8596306 | 0.77 | KDM4E (0.36) | ALDH1A1MAPT | |
| SCHEMBL28076647 | 0.77 | MAPT (0.45) | ALDH1A1MAPTALOX15HPGDNPY1R | |
| SCHEMBL8562235 | 0.76 | TDP1 (0.48) | ALDH1A1MAPTALOX15HPGDMAPK1 | |
| SCHEMBL8568828 | 0.76 | TDP1 (0.48) | ALDH1A1MAPTALOX15HPGDMAPK1 | |
| SCHEMBL8626672 | 0.75 | CA12 (0.33) | CA2CA12CA1CA9CA7 | |
| SCHEMBL8562052 | 0.75 | ALDH1A1 (0.50) | CA2CA1CA9CA5AALDH1A1 | |
| SCHEMBL8596090 | 0.75 | TXNRD1 (0.41) | ALDH1A1MAPTHPGDVCAM1NPY1R | |
| SCHEMBL8602041 | 0.74 | KDM4E (0.38) | — |
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-0735025-B1 | Process for producing aminonitropyridines | SUMITOMO CHEMICAL CO (JP) | 1998-07-01 | — | — | EP | disclosed |
| US-5648496-A | AMINATION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-07-15 | — | — | US | disclosed |
| EP-0735025-A1 | Process for producing aminonitropyridines | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-10-02 | — | — | EP | disclosed |