Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 16/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | OGA | O60502 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL980083 | 0.80 | GRM5 (0.50) | GRM5NPC1RAB9AHDAC3HDAC1 | |
| SCHEMBL980081 | 0.80 | GRM5 (0.50) | GRM5NPC1RAB9AHDAC3HDAC1 | |
| SCHEMBL12035524 | 0.76 | F10 (0.47) | F10OGAHDAC3HDAC1HDAC6 | |
| SCHEMBL741699 | 0.75 | F10 (0.46) | F10OGAHDAC3HDAC1HDAC6 | |
| SCHEMBL1251008 | 0.74 | F10 (0.50) | GRM5F10 | |
| SCHEMBL741444 | 0.73 | ADORA1 (0.55) | GRM5NPC1RAB9AF10 | |
| Hydrochloric Acid SCHEMBL209036 | 0.73 | F10 (0.49) | GRM5F10 | |
| SCHEMBL207703 | 0.73 | F10 (0.49) | GRM5F10 | |
| SCHEMBL210375 | 0.72 | ADORA1 (0.54) | GRM5NPC1RAB9AF10 | |
| SCHEMBL15014912 | 0.70 | RAD52 (0.60) | GRM5NPC1RAB9AF10HDAC3 |
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-2009037001-A2 | NOVEL TETRAHYDROFUSEDPYRIDINES AS HISTONE DEACETYLASE INHIBITORS | 4SC AG (DE) | 2009-03-26 | — | — | WO | disclosed |