Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 2/20 | 0.30 |
| ▸ | CA2 | P00918 | 2/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3485766 | 0.88 | EPHX2 (0.40) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL7505726 | 0.83 | CTSK (0.36) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL4583910 | 0.82 | HDAC6 (0.42) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL9201782 | 0.81 | TSHR (0.38) | CTSKCYP2D6EPHX2MLYCDTDP1 | |
| SCHEMBL948359 | 0.81 | PAOX (0.38) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL6191373 | 0.81 | TDP1 (0.42) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL308857 | 0.81 | EPHX2 (0.39) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| Hydrochloric Acid SCHEMBL30639492 | 0.80 | HDAC6 (0.41) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL3664095 | 0.80 | TDP1 (0.50) | CTSKCYP2D6TDP1MAOAMAOB | |
| SCHEMBL10250750 | 0.79 | EPHX2 (0.35) | HDAC6HDAC3HDAC1HDAC2HDAC8 |
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-1289565-B1 | COMPOUNDS FOR TARGETING ENDOTHELIAL CELLS | BRACCO SUISSE SA (CH) | 2015-04-22 | — | — | EP | disclosed |