Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8628187 | 0.81 | CA12 (0.35) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8597763 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| SCHEMBL8630082 | 0.80 | MEN1 (0.51) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL8566147 | 0.78 | KMT2A (0.53) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| SCHEMBL8597357 | 0.77 | ALDH1A1 (0.39) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL8597341 | 0.77 | MAPT (0.43) | ALDH1A1KDM4EKMT2AMEN1NPC1 | |
| SCHEMBL8581958 | 0.77 | KMT2A (0.54) | ALDH1A1KMT2AMEN1POLBMAPT | |
| SCHEMBL8626672 | 0.76 | CA12 (0.33) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8625161 | 0.76 | CYP19A1 (0.39) | ALDH1A1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL27597413 | 0.75 | CYP3A4 (0.41) | ALDH1A1KDM4EKMT2AMEN1POLB |
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 |