Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | VNN1 | O95497 | 5/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | BTD | P43251 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7986381 | 0.87 | HDAC3 (0.46) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL9245 | 0.83 | HDAC3 (0.48) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL1933893 | 0.80 | HDAC3 (0.51) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL14753612 | 0.80 | HDAC3 (0.46) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL20887447 | 0.79 | HDAC3 (0.48) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL19116553 | 0.79 | HPGD (0.45) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL23022741 | 0.79 | HDAC3 (0.50) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL29884167 | 0.79 | RECQL (0.53) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL21246171 | 0.79 | RECQL (0.53) | HDAC3HDAC1HDAC2HDAC6VNN1 | |
| SCHEMBL3003567 | 0.79 | NPSR1 (0.50) | HDAC3HDAC1HDAC2HDAC6VNN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0728752-A1 | Triazole compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-08-28 | — | — | EP | disclosed |
| US-5405861-A | Fungicides | TAKEDA CHEMICAL INDUSTRIES, CO., LTD. (JP) | 1995-04-11 | — | — | US | disclosed |
| EP-0421210-A2 | Triazole compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-04-10 | — | — | EP | disclosed |