Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 5/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9963155 | 0.72 | HDAC6 (0.43) | HDAC6HDAC1CHRM2HDAC8HDAC5 | |
| SCHEMBL12890048 | 0.71 | CHRNB2 (0.51) | CHRM2 | |
| SCHEMBL16945611 | 0.71 | CHRNB2 (0.51) | CHRM2 | |
| SCHEMBL13793382 | 0.70 | HDAC6 (0.42) | HDAC6HDAC1CHRM2HDAC8HDAC5 | |
| SCHEMBL14641475 | 0.69 | ALDH1A1 (0.50) | GRM5 | |
| SCHEMBL12888973 | 0.68 | CHRM2 (0.43) | HDAC6HDAC1CHRM2HDAC8HDAC5 | |
| SCHEMBL15934068 | 0.68 | CHRM2 (0.43) | HDAC6HDAC1CHRM2HDAC8HDAC5 | |
| SCHEMBL12890751 | 0.68 | CHRM2 (0.43) | HDAC6HDAC1CHRM2HDAC8HDAC5 | |
| SCHEMBL12905219 | 0.68 | CHRM2 (0.43) | HDAC6HDAC1CHRM2HDAC8HDAC5 | |
| SCHEMBL15934136 | 0.67 | CHRM2 (0.49) | HDAC6HDAC1CHRM2HDAC8 |
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-1237891-B1 | HETEROCYCLIC DIHYDROPYRIMIDINES AS POTASSIUM CHANNEL INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2011-09-28 | — | — | EP | disclosed |