Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.73 |
| ▸ | PTPRC | P08575 | 4/20 | 0.60 |
| ▸ | S100A4 | P26447 | 2/20 | 0.60 |
| ▸ | CES1 | P23141 | 2/20 | 0.60 |
| ▸ | BCHE | P06276 | 1/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | STAT6 | P42226 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL27477775 | 0.91 | PTPRC (0.71) | ALDH1A1LMNAPTPRCS100A4CES1 | |
| Nitrobenzene SCHEMBL15525745 | 0.85 | ALDH1A1 (1.00) | ALDH1A1LMNACES1ACHEMAPK1 | |
| Nitrobenzene SCHEMBL2255264 | 0.85 | ALDH1A1 (1.00) | ALDH1A1LMNACES1ACHEMAPK1 | |
| Nitrobenzene SCHEMBL2358164 | 0.85 | ALDH1A1 (1.00) | ALDH1A1LMNACES1ACHEMAPK1 | |
| Nitrobenzene SCHEMBL9669095 | 0.85 | — | — | |
| Nitrobenzene SCHEMBL1330825 | 0.85 | — | — | |
| Nitrobenzene SCHEMBL1330714 | 0.85 | — | — | |
| Nitrobenzene SCHEMBL20411 | 0.85 | — | — | |
| Nitrobenzene SCHEMBL25293390 | 0.83 | ALDH1A1 (0.94) | ALDH1A1LMNACES1ACHEMAPK1 | |
| Nitrobenzene SCHEMBL11762834 | 0.83 | ALDH1A1 (0.94) | ALDH1A1LMNACES1ACHEMAPK1 |
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-1106167-A2 | Dye compositions for keratin fibers comprising a nonionic compound | L'OREAL (FR) | 2001-06-13 | — | — | EP | disclosed |