Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CD44 | P16070 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| 2,5-Xylidine SCHEMBL9751765 | 0.96 | ALDH1A1 (0.63) | ALDH1A1TDP1CYP3A4TSHRPIK3CA | |
| 2,5-Xylidine SCHEMBL27949130 | 0.85 | TDP1 (0.77) | ALDH1A1TDP1CYP3A4ALOX15TP53 | |
| 2,5-Xylidine SCHEMBL11124717 | 0.85 | TDP1 (0.77) | ALDH1A1TDP1CYP3A4TSHRALOX15 | |
| SCHEMBL10830774 | 0.84 | CYP3A4 (0.50) | ALDH1A1TDP1CYP3A4TSHRPIK3CA | |
| SCHEMBL15024 | 0.82 | — | — | |
| SCHEMBL29440219 | 0.82 | — | — | |
| 2,5-Xylidine SCHEMBL70824 | 0.82 | — | — | |
| SCHEMBL28788726 | 0.82 | CYP3A4 (0.72) | ALDH1A1TDP1CYP3A4TSHRPIK3CA | |
| 2,5-Xylidine SCHEMBL33981 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TDP1CYP3A4TSHRPIK3CA | |
| Hydrochloric Acid SCHEMBL2188812 | 0.80 | CYP3A4 (0.68) | ALDH1A1TDP1CYP3A4TSHRPIK3CA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5919982-A | Process and apparatus for the removal of aromatic amines from soil and water | HER MAJESTY THE QUEEN IN RIGHT OF CANADA, AS REPRESENTED BY ENVIRONMENT (CA) | 1999-07-06 | — | — | US | disclosed |
| WO-1997046331-A1 | PROCESS AND APPARATUS FOR THE REMOVAL OF AROMATIC AMINES FROM SOIL AND WATER | HER MAJESTY IN RIGHT OF CANADA, represented by ENVIRONMENT CANADA (CA) | 1997-12-11 | — | — | WO | disclosed |