Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 4/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.33 |
| ▸ | MLNR | O43193 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL14720472 | 0.85 | ALDH1A1 (0.38) | POLBHRH3CYP2D6MLNRALDH1A1 | |
| SCHEMBL14720768 | 0.76 | KCNH2 (0.44) | SRD5A2POLBHRH3CYP2D6MLNR | |
| SCHEMBL14721184 | 0.73 | POLB (0.39) | SRD5A2POLBHRH3CYP2D6ALDH1A1 | |
| SCHEMBL14721402 | 0.73 | MAPT (0.44) | SRD5A2POLBHRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL14720491 | 0.72 | HRH3 (0.45) | SRD5A2POLBHRH3CYP2D6MLNR | |
| SCHEMBL14721067 | 0.72 | SRD5A2 (0.42) | SRD5A2HRH3CYP2D6ALDH1A1SRD5A1 | |
| SCHEMBL14721400 | 0.72 | SRD5A2 (0.48) | SRD5A2POLBHRH3ALDH1A1KMT2A | |
| SCHEMBL14722546 | 0.71 | USP2 (0.45) | SRD5A2HRH3 | |
| SCHEMBL14720551 | 0.71 | ALDH1A1 (0.56) | POLBALDH1A1SMN1; SMN2 | |
| SCHEMBL14731083 | 0.71 | SRD5A2 (0.46) | SRD5A2POLBHRH3ALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | claimed |
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |