Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 11/20 | 0.35 |
| ▸ | PRKACA | P17612 | 2/20 | 0.35 |
| ▸ | PRKACG | P22612 | 2/20 | 0.35 |
| ▸ | PRKACB | P22694 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28281370 | 0.79 | DRD2 (0.30) | — | |
| SCHEMBL7517397 | 0.75 | — | — | |
| SCHEMBL5532673 | 0.75 | — | — | |
| SCHEMBL7528956 | 0.75 | — | — | |
| Propylene Oxide SCHEMBL29238686 | 0.72 | NPC1 (0.41) | NPC1MEN1ESR1KMT2ACYP1A2 | |
| Phosphine SCHEMBL27544257 | 0.69 | — | — | |
| Water SCHEMBL27620318 | 0.69 | — | — | |
| SCHEMBL7128135 | 0.68 | TSHR (0.63) | SLC6A2SLC6A3SLC6A4 | |
| Acetonitrile SCHEMBL28637916 | 0.68 | — | — | |
| Nitrogen SCHEMBL3165748 | 0.66 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109503454-A | A kind of preparation method of Benzazole compounds | 北京化工大学 | 2019-03-22 | — | — | CN | disclosed |