Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1287837 | 0.79 | ALDH1A1 (0.74) | ALDH1A1TDP1GPR35L3MBTL1PTPN1 | |
| SCHEMBL30535903 | 0.79 | ALDH1A1 (0.74) | ALDH1A1TDP1GPR35L3MBTL1PTPN1 | |
| SCHEMBL6670434 | 0.78 | ALDH1A1 (0.45) | ALDH1A1TDP1GPR35L3MBTL1MAPT | |
| Ammonia Solution, Strong SCHEMBL9060371 | 0.77 | ALDH1A1 (0.71) | ALDH1A1TDP1GPR35L3MBTL1MAOB | |
| SCHEMBL30987815 | 0.77 | ALDH1A1 (0.71) | ALDH1A1TDP1GPR35L3MBTL1PTPN1 | |
| SCHEMBL29337140 | 0.77 | ALDH1A1 (0.71) | ALDH1A1TDP1GPR35L3MBTL1PTPN1 | |
| SCHEMBL25783900 | 0.76 | GPR35 (0.65) | ALDH1A1TDP1GPR35MAPTPOLB | |
| SCHEMBL5707256 | 0.76 | ALDH1A1 (0.59) | ALDH1A1TDP1GPR35MAPTPOLB | |
| SCHEMBL5492471 | 0.75 | — | — | |
| SCHEMBL9397164 | 0.74 | ALDH1A1 (0.52) | ALDH1A1TDP1L3MBTL1MAOBMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0604705-B1 | 4-Hydroxy-2'-nitrobutyrophenone and tetrahydro-2-(o-nitrophenyl)-2-furanol useful as intermediates in the preparation of a crop-selective herbicide | AMERICAN CYANAMID CO (US) | 1996-10-09 | — | — | EP | disclosed |