Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.44 |
| ▸ | TUBB | P07437 | 2/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6028351 | 0.91 | KMT2A (0.54) | MAPTTSHRALOX12ALDH1A1GABRA1 | |
| SCHEMBL5034663 | 0.79 | KMT2A (0.54) | MAPTTSHRALOX12SMN1; SMN2GABRA1 | |
| SCHEMBL4709491 | 0.78 | TUBB4A (0.55) | MAPTTSHRALOX12SMN1; SMN2ALDH1A1 | |
| SCHEMBL6028587 | 0.78 | TUBB4A (0.51) | ALDH1A1GABRA1GABRA5GABRA3GABRA2 | |
| SCHEMBL6268726 | 0.74 | TUBB4A (0.53) | TSHRALDH1A1GABRA1GABRA5GABRA3 | |
| SCHEMBL6669471 | 0.74 | ALDH1A1 (0.53) | MAPTTSHRALOX12SMN1; SMN2ALDH1A1 | |
| SCHEMBL18166499 | 0.74 | GABRA1 (0.56) | MAPTTSHRALOX12SMN1; SMN2ALDH1A1 | |
| SCHEMBL5490530 | 0.71 | TUBB4A (0.55) | SMN1; SMN2GABRA1GABRA5GABRA3GABRA2 | |
| SCHEMBL1365846 | 0.70 | GABRA1 (0.69) | MAPTTSHRALOX12SMN1; SMN2GABRA1 | |
| SCHEMBL1421181 | 0.70 | KMT2A (0.82) | MAPTTSHRALOX12ALDH1A1GABRA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1697332-A1 | BENZO'1,4 ! DIAZEPIN-2-ONE DERIVATIVES AS PHOSPHODIESTERASE PDE2 INHIBITORS, PREPARATION AND THERAPEUTIC USE THEREOF | NEURO3D (FR) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005063723-A1 | BENZO`1,4 ! DIAZEPIN-2-ONE DERIVATIVES AS PHOSPHODIESTERASE PDE2 INHIBITORS, PREPARATION AND THERAPEUTIC USE THEREOF | NEURO3D (FR) | 2005-07-14 | — | — | WO | disclosed |