Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 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 | |
|---|---|---|---|---|
| SCHEMBL7972730 | 0.88 | HTT (0.37) | HDAC8HDAC6P2RX7 | |
| SCHEMBL4058383 | 0.82 | KDM4E (0.32) | — | |
| SCHEMBL4058384 | 0.82 | KDM4E (0.32) | — | |
| SCHEMBL4392496 | 0.80 | KDM1A (0.41) | P2RX7 | |
| SCHEMBL4392500 | 0.80 | KDM1A (0.41) | P2RX7 | |
| Hydrochloric Acid SCHEMBL7906091 | 0.79 | KDM1A (0.40) | P2RX7 | |
| SCHEMBL7761724 | 0.77 | PSEN1 (0.35) | — | |
| SCHEMBL4245803 | 0.75 | — | — | |
| SCHEMBL4245801 | 0.75 | — | — | |
| SCHEMBL6198272 | 0.75 | ATM (0.33) | — |
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-2001005767-A1 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2001-01-25 | — | — | WO | disclosed |