Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.31 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL462082 | 0.75 | CYP3A4 (0.46) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8773347 | 0.69 | CYP3A4 (0.39) | CYP3A4 | |
| SCHEMBL9676287 | 0.69 | CYP3A4 (0.39) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20599288 | 0.68 | CYP3A4 (0.42) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4543299 | 0.67 | CYP3A4 (0.38) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4191136 | 0.67 | CYP3A4 (0.38) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7768570 | 0.67 | CYP3A4 (0.38) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27539864 | 0.67 | CYP3A4 (0.38) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27797024 | 0.67 | CYP3A4 (0.38) | CYP3A4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8958844 | 0.67 | CYP3A4 (0.46) | CYP3A4HDAC3HDAC4HDAC1HDAC7 |
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-0670316-B1 | 1,3,6-Trialkylhexahydro-1,3,6-triazocine-2-one and preparation process thereof | MITSUI TOATSU CHEMICALS (JP) | 1997-09-03 | — | — | EP | claimed |
| JP-7291949-A | — | — | None | — | — | JP | disclosed |
| JP-H07291949-A | 1,3,6-TRIALKYLHEXAHYDRO-1,3,6-TRIAZOCIN-2-ONE AND PRODUCTION THEREOF | MITSUI TOATSU CHEM INC | 1995-11-07 | — | — | JP | disclosed |