Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.47 |
| ▸ | TUBB | P07437 | 3/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.47 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.47 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.47 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.47 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.47 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.47 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.47 |
| ▸ | TUBA1C | Q9BQE3 | 3/20 | 0.47 |
| ▸ | TUBB6 | Q9BUF5 | 3/20 | 0.47 |
| ▸ | TUBB2B | Q9BVA1 | 3/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2845433 | 1.00 | ACHE (0.50) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL12969432 | 0.82 | ACHE (0.44) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL5770364 | 0.81 | MAPT (0.48) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL9352044 | 0.80 | ACHE (0.52) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL3596792 | 0.79 | POLB (0.42) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL27410690 | 0.76 | ACHE (0.43) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL14511738 | 0.76 | ACHE (0.43) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL9522146 | 0.74 | ACHE (0.46) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL17998034 | 0.74 | POLB (0.38) | ACHETUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL1243920 | 0.73 | ACHE (0.56) | ACHETUBB1TUBB4ATUBBTUBA3C |
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-2152670-A1 | BRIDGED SIX-MEMBERED RING COMPOUNDS | Actelion Pharmaceuticals Ltd. (CH) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008132679-A1 | BRIDGED SIX-MEMBERED RING COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-11-06 | — | — | WO | disclosed |