Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TXNRD1 | Q16881 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | GSR | P00390 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8562148 | 0.82 | ALDH1A1 (0.48) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL8566147 | 0.80 | KMT2A (0.53) | ALDH1A1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL8563598 | 0.79 | LMNA (0.55) | ALDH1A1CYP1A2CYP3A4MAPK1KMT2A | |
| SCHEMBL8562052 | 0.78 | ALDH1A1 (0.50) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL8563877 | 0.77 | TXNRD1 (0.63) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL8597763 | 0.77 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL28274690 | 0.75 | SMN1; SMN2 (0.50) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL28274692 | 0.75 | TSHR (0.50) | ALDH1A1CYP2C9CYP2C19CYP3A4HPGD | |
| SCHEMBL8564974 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HIF1ACYP1A2ALOX15ALOX12 | |
| SCHEMBL31028752 | 0.74 | CA1 (0.50) | ALDH1A1CYP2C9MAPK1HPGDMEN1 |
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 |