Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.31 |
| ▸ | EDNRB | P24530 | 1/20 | 0.30 |
| ▸ | EDNRA | P25101 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9843450 | 0.86 | DRD2 (0.31) | NPSR1DRD2 | |
| SCHEMBL9727737 | 0.71 | ESR1 (0.42) | — | |
| SCHEMBL9727495 | 0.68 | ALDH1A1 (0.43) | CYP3A4EDNRBEDNRA | |
| SCHEMBL9727708 | 0.68 | ALDH1A1 (0.42) | CYP3A4ALOX5 | |
| SCHEMBL4654931 | 0.66 | DRD2 (0.46) | DRD2 | |
| SCHEMBL9727705 | 0.65 | ABCB1 (0.41) | CYP3A4DRD2 | |
| SCHEMBL9727728 | 0.65 | NR1I2 (0.32) | — | |
| SCHEMBL2675281 | 0.65 | PPARA (0.53) | CYP3A4CYP11B1CYP11B2 | |
| SCHEMBL8503579 | 0.64 | SLC6A2 (0.38) | DRD2TNKS2 | |
| SCHEMBL7631655 | 0.63 | DRD2 (0.48) | CYP3A4POLBDRD2 |
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 |