Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20847618 | 0.79 | CA2 (0.45) | HDAC8HDAC6HDAC3HDAC11TSHR | |
| SCHEMBL20847640 | 0.78 | HDAC6 (0.48) | HDAC8HDAC6HDAC3HDAC11TSHR | |
| SCHEMBL26453624 | 0.73 | MMP1 (0.34) | HDAC8CA2MMP1MMP2MMP9 | |
| SCHEMBL20847659 | 0.68 | HDAC6 (0.67) | HDAC8HDAC6HDAC3HDAC11TSHR | |
| SCHEMBL20847653 | 0.66 | HDAC8 (0.50) | HDAC8HDAC6HDAC3HDAC11GAA | |
| SCHEMBL23793202 | 0.65 | BMP1 (0.44) | HDAC8HDAC6HDAC3HDAC11CA2 | |
| SCHEMBL20847508 | 0.64 | HDAC6 (0.48) | HDAC8HDAC6HDAC3HDAC11TSHR | |
| SCHEMBL17914539 | 0.64 | MCHR1 (0.38) | TSHRMAPK1HTR2AP2RX7PER2 | |
| SCHEMBL20847620 | 0.64 | HDAC6 (0.46) | HDAC8HDAC6HDAC3HDAC11 | |
| SCHEMBL12169264 | 0.63 | GABRA1 (0.39) | LMNASMN1; SMN2MMP1HTR2AP2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019056120-A1 | PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF | DALRIADA THERAPEUTICS INC. (CA) | 2019-03-28 | — | — | WO | disclosed |