Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 13/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.57 |
| ▸ | HDAC4 | P56524 | 8/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.53 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14917960 | 0.89 | HDAC6 (0.67) | HDAC6HDAC1HDAC4CYP1A2CYP3A4 | |
| SCHEMBL14918277 | 0.89 | HDAC6 (0.66) | HDAC6HDAC1HDAC4CYP1A2CYP3A4 | |
| SCHEMBL17394582 | 0.87 | HDAC6 (0.56) | HDAC6HDAC1HDAC4CYP3A4HDAC8 | |
| SCHEMBL14917912 | 0.87 | HDAC6 (0.59) | HDAC6HDAC1HDAC4HDAC8 | |
| SCHEMBL14917947 | 0.87 | HDAC6 (0.59) | HDAC6HDAC1HDAC4HDAC8 | |
| SCHEMBL14918189 | 0.85 | HDAC6 (0.53) | HDAC6HDAC1HDAC4CYP3A4HDAC8 | |
| SCHEMBL14918170 | 0.83 | HDAC6 (0.63) | HDAC6HDAC1HDAC4CYP1A2CYP3A4 | |
| SCHEMBL14918136 | 0.82 | HDAC6 (0.59) | HDAC6HDAC1HDAC4HDAC8 | |
| SCHEMBL14918355 | 0.82 | HDAC6 (0.60) | HDAC6HDAC1HDAC4HDAC8 | |
| SCHEMBL17394598 | 0.76 | HDAC6 (0.65) | HDAC6HDAC1HDAC4HDAC8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013066839-A2 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2013-05-10 | — | — | WO | claimed |
| WO-2013066839-A2 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2013-05-10 | — | — | WO | disclosed |