Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16716800 | 1.00 | HDAC3 (0.39) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL12252985 | 1.00 | HDAC3 (0.39) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL24445633 | 0.82 | HDAC3 (0.41) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL15154440 | 0.80 | CYP2D6 (0.41) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9978528 | 0.80 | CYP2D6 (0.41) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9978529 | 0.80 | CYP2D6 (0.41) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL27929482 | 0.78 | TSHR (0.44) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL18546129 | 0.78 | HDAC3 (0.38) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL17254396 | 0.78 | HDAC3 (0.38) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL16716791 | 0.76 | ALOX15 (0.46) | CYP2D6TSHR |
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-2015071292-A1 | METHOD FOR PRODUCING CHIRAL COMPOUNDS | Bergische Universität Wuppertal (DE) | 2015-05-21 | — | — | WO | disclosed |