Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PTPRC | P08575 | 3/20 | 0.44 |
| ▸ | S100A4 | P26447 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | STAT6 | P42226 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL919023 | 0.80 | ALDH1A1 (0.57) | ALDH1A1CYP3A4TSHRPTPRCS100A4 | |
| SCHEMBL295307 | 0.74 | ALDH1A1 (0.49) | ALDH1A1CYP3A4PTPRCS100A4NPC1 | |
| Methane SCHEMBL4141657 | 0.73 | ALDH1A1 (0.47) | ALDH1A1CYP3A4PTPRCS100A4NPC1 | |
| Methane SCHEMBL28696439 | 0.73 | ALDH1A1 (0.47) | ALDH1A1CYP3A4PTPRCS100A4NPC1 | |
| SCHEMBL28251834 | 0.72 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRPTPRCS100A4 | |
| SCHEMBL29658111 | 0.72 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRPTPRCS100A4 | |
| SCHEMBL11676272 | 0.71 | ALDH1A1 (0.51) | ALDH1A1CYP3A4TSHRPTPRCS100A4 | |
| SCHEMBL10626632 | 0.71 | MAPT (0.53) | ALDH1A1CYP3A4TSHRPTPRCS100A4 | |
| SCHEMBL11424411 | 0.70 | ALDH1A1 (0.62) | ALDH1A1CYP3A4TSHRPTPRCS100A4 | |
| SCHEMBL9344552 | 0.70 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRPTPRCS100A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002024837-A1 | METHOD FOR DENITROGENATION OF OIL FRACTIONS BY FORMING CHARGE TRANSFER COMPLEXES | TOTALFINAELF FRANCE (FR) | 2002-03-28 | — | — | WO | claimed |
| WO-2002024837-A1 | METHOD FOR DENITROGENATION OF OIL FRACTIONS BY FORMING CHARGE TRANSFER COMPLEXES | TOTALFINAELF FRANCE (FR) | 2002-03-28 | — | — | WO | disclosed |