Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.58 |
| ▸ | MMP12 | P39900 | 4/20 | 0.54 |
| ▸ | MMP2 | P08253 | 1/20 | 0.54 |
| ▸ | MMP9 | P14780 | 1/20 | 0.54 |
| ▸ | MMP13 | P45452 | 1/20 | 0.54 |
| ▸ | MMP14 | P50281 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14360024 | 0.84 | HDAC3 (0.54) | HDAC2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL14359790 | 0.81 | TBXAS1 (0.54) | HDAC2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL14359799 | 0.81 | HDAC3 (0.59) | HDAC2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL4558971 | 0.80 | SMN1; SMN2 (0.47) | HDAC2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL1651413 | 0.79 | FFAR1 (0.78) | FFAR1MMP12MMP2MMP9MMP13 | |
| SCHEMBL11699823 | 0.78 | TDP1 (0.63) | HDAC2HDAC3HDAC4HDAC1SMN1; SMN2 | |
| SCHEMBL1958621 | 0.77 | FFAR1 (0.75) | FFAR1MMP12MMP13HDAC2HDAC3 | |
| SCHEMBL3146207 | 0.77 | TBXAS1 (0.58) | HDAC2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL22971576 | 0.76 | GABBR2 (0.51) | HDAC2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL7712810 | 0.76 | CYSLTR2 (0.55) | HDAC2HDAC3MAPK1ADRA1AHDAC4 |
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-2009080722-A2 | CARBOXYLIC DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2009-07-02 | — | — | WO | disclosed |