Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 8/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | TTR | P02766 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 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 | |
|---|---|---|---|---|
| Trinitrophenol SCHEMBL14675401 | 0.84 | GPR35 (0.69) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL11803127 | 0.84 | TTR (0.48) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL11799318 | 0.84 | GPR35 (0.54) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL11807213 | 0.84 | GPR35 (0.54) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL11806688 | 0.84 | GPR35 (0.56) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| Trinitrophenol SCHEMBL10361561 | 0.82 | GPR35 (0.76) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL6325040 | 0.81 | GPR35 (0.61) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| Trinitrophenol SCHEMBL9146204 | 0.80 | GPR35 (0.73) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| Trinitrophenol SCHEMBL253750 | 0.80 | GPR35 (0.79) | GPR35ALDH1A1KMT2AMEN1HPGD | |
| Trinitrophenol SCHEMBL8744 | 0.80 | GPR35 (0.79) | GPR35ALDH1A1KMT2AMEN1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-3933472-A | Substituted alkylaryl ketones and methods of use as herbicides | BUCKMAN LABORATORIES, INC. (US) | 1976-01-20 | — | — | US | disclosed |