Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BIRC2 | Q13490 | 4/20 | 0.38 |
| ▸ | XIAP | P98170 | 3/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 6/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 6/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2481250 | 1.00 | BIRC2 (0.38) | BIRC2XIAPCHRNB2CHRNA4CHRNB4 | |
| SCHEMBL2258099 | 0.76 | SIGMAR1 (0.46) | TACR1SLC6A4KCNH2SIGMAR1 | |
| SCHEMBL20317464 | 0.73 | SLC6A3 (0.43) | BIRC2XIAPSLC6A4KCNH2 | |
| SCHEMBL27744670 | 0.73 | ACHE (0.57) | SIGMAR1 | |
| SCHEMBL2256078 | 0.72 | SIGMAR1 (0.49) | SIGMAR1 | |
| SCHEMBL3144417 | 0.71 | MLNR (0.50) | XIAPSLC6A4KCNH2 | |
| SCHEMBL3137966 | 0.71 | MLNR (0.50) | XIAPSLC6A4KCNH2 | |
| SCHEMBL3137952 | 0.71 | MLNR (0.50) | XIAPSLC6A4KCNH2 | |
| SCHEMBL20317594 | 0.69 | SLC6A3 (0.58) | SLC6A4KCNH2SIGMAR1 | |
| SCHEMBL1631114 | 0.69 | SMN1; SMN2 (0.55) | BIRC2XIAP |
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-2373657-A1 | 5, 7-DIHYDRO- 6H-PYRIMIDO Ý 5, 4-D¨Ý 1¨BENZAZEPIN-6-THIONES AS PLK INHIBITORS | Millennium Pharmaceuticals, Inc. (US) | 2011-10-12 | — | — | EP | disclosed |
| WO-2010065134-A1 | 5, 7-DIHYDRO- 6H-PYRIMIDO [ 5, 4-D] [ 1 ] BENZAZEPIN-6-THIONES AS PLK INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2010-06-10 | — | — | WO | disclosed |