Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | BACE1 | P56817 | 6/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HSD3B2 | P26439 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9005074 | 1.00 | HSD11B1 (0.38) | HSD11B1CYP2C9BACE1CYP3A4HSD3B2 | |
| SCHEMBL4771886 | 0.87 | HSD11B1 (0.36) | HSD11B1CYP2C9CYP3A4HSD3B2CYP2C19 | |
| SCHEMBL3454385 | 0.87 | HSD11B1 (0.36) | HSD11B1CYP2C9CYP3A4HSD3B2CYP2C19 | |
| SCHEMBL7862053 | 0.86 | BACE1 (0.39) | BACE1HCAR3HCAR2CNR1ALDH1A1 | |
| SCHEMBL6942603 | 0.86 | BACE1 (0.39) | BACE1HCAR3HCAR2CNR1ALDH1A1 | |
| SCHEMBL8106827 | 0.86 | BACE1 (0.39) | BACE1HCAR3HCAR2CNR1ALDH1A1 | |
| SCHEMBL18754946 | 0.81 | PDE2A (0.37) | — | |
| SCHEMBL19904901 | 0.81 | BACE1 (0.38) | BACE1HCAR3HCAR2CNR1ALDH1A1 | |
| SCHEMBL6151991 | 0.79 | BACE1 (0.35) | BACE1HCAR3HCAR2CNR1ALDH1A1 | |
| SCHEMBL8780969 | 0.79 | HSD11B1 (0.39) | HSD11B1CYP2C9BACE1CYP3A4HCAR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0567982-B1 | Azole compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1998-07-01 | — | — | EP | disclosed |
| US-5466820-A | Fungicides | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-11-14 | — | — | US | disclosed |
| US-5371101-A | Fungicides | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-12-06 | — | — | US | disclosed |
| EP-0567982-A1 | Azole compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1993-11-03 | — | — | EP | disclosed |