Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9727488 | 0.84 | ABCB1 (0.43) | ABCB1HTR1ADRD2 | |
| SCHEMBL9727672 | 0.84 | ABCB1 (0.43) | ABCB1HTR1ADRD2 | |
| SCHEMBL9727708 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TP53CYP3A4ALOX15TSHR | |
| SCHEMBL9727783 | 0.74 | ALDH1A1 (0.42) | MEN1KMT2AALDH1A1TP53CYP3A4 | |
| SCHEMBL21363609 | 0.74 | CYP3A4 (0.48) | BCHEALDH1A1TP53CYP3A4ALOX15 | |
| SCHEMBL4231254 | 0.73 | MAOB (0.51) | ABCB1BCHEMEN1KMT2AALDH1A1 | |
| SCHEMBL9727762 | 0.70 | NR3C1 (0.38) | ABCB1BCHEMEN1KMT2AALDH1A1 | |
| SCHEMBL9727495 | 0.69 | ALDH1A1 (0.43) | MEN1KMT2AALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL14552348 | 0.69 | MAOB (0.54) | MEN1KMT2AALDH1A1TP53CYP3A4 | |
| SCHEMBL27859426 | 0.67 | ALOX5 (0.50) | BCHEMEN1KMT2AALDH1A1SMN1; SMN2 |
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-5091533-A | Treating allergies, cardiovascular disorders, inflammation | MERCK FROSST CANADA, INC. (CA) | 1992-02-25 | — | — | US | disclosed |
| EP-0447189-A1 | 5-Hydroxy-2,3-dihydrobenzofuran analogs as leukotriene biosynthesis inhibitors | MERCK FROSST CANADA INC. (CA) | 1991-09-18 | — | — | EP | disclosed |