Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 2/20 | 0.34 |
| ▸ | RARG | P13631 | 2/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.31 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9328657 | 0.80 | ALDH1A1 (0.38) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL11475065 | 0.78 | ALDH1A1 (0.38) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL5360647 | 0.71 | ALDH1A1 (0.41) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL1634590 | 0.71 | ALDH1A1 (0.41) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL23605753 | 0.70 | ALOX15 (0.40) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL19928616 | 0.69 | ALDH1A1 (0.42) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL9329230 | 0.69 | RARB (0.33) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL31502587 | 0.68 | ALDH1A1 (0.46) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL3839248 | 0.68 | HAO1 (0.43) | CYP1A2ALDH1A1GAAMAPTNPSR1 | |
| SCHEMBL13779270 | 0.67 | ALDH1A1 (0.41) | CYP1A2ALDH1A1GAAMAPTNPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0461972-B1 | Process for the conversion of N-tertiary amine oxides into aldehydes | RHONE POULENC NUTRITION ANIMAL (FR) | 1994-03-30 | — | — | EP | claimed |
| US-5202497-A | Catalytic oxidation of allylic tertiary amines | RHONE-POULENC NUTRITION ANIMALE (FR) | 1993-04-13 | — | — | US | claimed |
| US-5202497-A | Catalytic oxidation of allylic tertiary amines | RHONE-POULENC NUTRITION ANIMALE (FR) | 1993-04-13 | — | — | US | disclosed |