Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.44 |
| ▸ | GABRP | O00591 | 2/20 | 0.39 |
| ▸ | GABRD | O14764 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.39 |
| ▸ | GABRE | P78334 | 2/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.39 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.39 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8566366 | 0.86 | ALDH1A1 (0.42) | ALDH1A1TDP1CYP3A4ALOX15KMT2A | |
| SCHEMBL8564125 | 0.85 | ALDH1A1 (0.33) | ALDH1A1TDP1CYP3A4ALOX15MAPT | |
| SCHEMBL8559950 | 0.78 | ALDH1A1 (0.39) | ALDH1A1CYP3A4KMT2AMAPTMEN1 | |
| SCHEMBL8566803 | 0.78 | ALOX15 (0.44) | ALDH1A1TDP1CYP3A4ALOX15KMT2A | |
| SCHEMBL8562881 | 0.77 | MAPK1 (0.37) | ALDH1A1MAPTPOLBMAPK1 | |
| SCHEMBL8562235 | 0.76 | TDP1 (0.48) | ALDH1A1TDP1CYP3A4ALOX15KMT2A | |
| SCHEMBL8568828 | 0.76 | TDP1 (0.48) | ALDH1A1TDP1CYP3A4ALOX15KMT2A | |
| SCHEMBL8567302 | 0.75 | RAB9A (0.51) | ALDH1A1TDP1CYP3A4KMT2AMAPT | |
| SCHEMBL8566566 | 0.75 | CYP1A2 (0.52) | CYP3A4KMT2AMEN1CYP2C19LMNA | |
| SCHEMBL8599052 | 0.75 | HTT (0.40) | ALDH1A1GABRPGABRDGABRA1GABRB1 |
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 |