Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.49 |
| ▸ | TUBB | P07437 | 1/20 | 0.49 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.49 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.49 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.49 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.49 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.49 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.49 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.49 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.49 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.49 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.49 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.49 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12431897 | 0.80 | ALDH1A1 (0.60) | MAPK1MAPTHPGDL3MBTL1FNTA | |
| SCHEMBL10196055 | 0.78 | ACHE (0.70) | ACHEMAPK1MAPTHPGDL3MBTL1 | |
| SCHEMBL11841088 | 0.76 | PTGS2 (0.59) | ACHEMAPTTUBB1TUBB4ATUBB | |
| SCHEMBL257799 | 0.74 | MAPK1 (0.51) | MAPK1MAPTHPGDL3MBTL1KMT2A | |
| SCHEMBL12431887 | 0.73 | MAPT (0.53) | ACHEMAPK1MAPTL3MBTL1FNTA | |
| SCHEMBL3753027 | 0.73 | ACHE (0.52) | ACHEMAPK1MAPTHPGDL3MBTL1 | |
| SCHEMBL7961363 | 0.72 | PTGS2 (0.64) | ACHEMAPTTUBB1TUBB4ATUBB | |
| SCHEMBL7959757 | 0.72 | PTGS2 (0.64) | ACHEMAPTTUBB1TUBB4ATUBB | |
| SCHEMBL171116 | 0.71 | ACHE (1.00) | ACHEMAPTHPGDL3MBTL1TUBB1 | |
| SCHEMBL12432443 | 0.70 | MAOB (0.53) | ACHEMAPTHPGDL3MBTL1TUBB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9914732-B2 | Diazabicyclo[4.3.1]decane derivatives for treatment of psychiatric disorders | MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSC HAFTEN E.V. (DE) | 2018-03-13 | — | — | US | disclosed |