Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.45 |
| ▸ | TXNRD1 | Q16881 | 3/20 | 0.43 |
| ▸ | GSR | P00390 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8563296 | 0.82 | ALDH1A1 (0.51) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL8568477 | 0.82 | KMT2A (0.44) | ALDH1A1NPC1RAB9APOLBMEN1 | |
| SCHEMBL8566342 | 0.81 | ALDH1A1 (0.48) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL8563864 | 0.81 | NSD2 (0.49) | CYP1A2CYP3A4SMN1; SMN2KDM4EPOLB | |
| SCHEMBL8562052 | 0.77 | ALDH1A1 (0.50) | ALDH1A1CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL8602563 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HTTKDM4EMEN1KMT2A | |
| SCHEMBL8565961 | 0.76 | CA2 (0.39) | ALDH1A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL8561302 | 0.75 | NT5E (0.41) | ALDH1A1CYP2C19HIF1ACYP1A2HSD17B10 | |
| SCHEMBL28823853 | 0.75 | TSHR (0.51) | ALDH1A1HPGDHSD17B10RAB9ATSHR | |
| SCHEMBL8596657 | 0.75 | TXNRD1 (0.43) | ALDH1A1CYP2C19CYP1A2CYP3A4HPGD |
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 |