Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CAD | P27708 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL867273 | 0.77 | — | — | |
| SCHEMBL15259582 | 0.75 | HDAC7 (0.39) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL9683902 | 0.75 | TAS1R3 (0.48) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL28189976 | 0.74 | TSHR (0.47) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL28829367 | 0.73 | — | — | |
| SCHEMBL292612 | 0.73 | — | — | |
| SCHEMBL9911187 | 0.72 | LMNA (0.41) | LMNATDP1CADCYP3A4TSHR | |
| SCHEMBL292771 | 0.71 | TAS1R3 (0.49) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL9953741 | 0.71 | CAD (0.43) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL28229742 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0317998-A2 | Manufacturing method of optically-active 1,2-diols | KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1989-05-31 | — | — | EP | disclosed |