Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | CDC7 | O00311 | 8/20 | 0.55 |
| ▸ | DBF4 | Q9UBU7 | 8/20 | 0.55 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | IKBKB | O14920 | 1/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.55 |
| ▸ | CHUK | O15111 | 1/20 | 0.55 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
| ▸ | PIM1 | P11309 | 1/20 | 0.55 |
| ▸ | PRKACA | P17612 | 1/20 | 0.55 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.55 |
| ▸ | CDK2 | P24941 | 1/20 | 0.55 |
| ▸ | MARK3 | P27448 | 1/20 | 0.55 |
| ▸ | AKT1 | P31749 | 1/20 | 0.55 |
| ▸ | FLT4 | P35916 | 1/20 | 0.55 |
| ▸ | KDR | P35968 | 1/20 | 0.55 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.55 |
| ▸ | GSK3A | P49840 | 1/20 | 0.55 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL12969907 | 0.88 | CDC7 (0.53) | SMN1; SMN2CDC7DBF4PLK4IKBKB | |
| SCHEMBL12969908 | 0.87 | KDM4E (0.63) | SMN1; SMN2CDC7DBF4PLK4IKBKB | |
| SCHEMBL12969830 | 0.82 | CDC7 (0.58) | SMN1; SMN2CDC7DBF4PLK4IKBKB | |
| SCHEMBL12817782 | 0.82 | MAPK1 (0.64) | CDC7DBF4PLK4IKBKBAURKA | |
| SCHEMBL12969822 | 0.77 | IKBKB (0.61) | CDC7DBF4PLK4IKBKBAURKA | |
| SCHEMBL12969827 | 0.75 | CDC7 (0.52) | CDC7DBF4PLK4IKBKBAURKA | |
| SCHEMBL4903009 | 0.72 | CDC7 (1.00) | CDC7DBF4PLK4IKBKBAURKA | |
| SCHEMBL4903131 | 0.71 | IKBKB (0.55) | CDC7DBF4PLK4IKBKBAURKA | |
| SCHEMBL12969828 | 0.71 | CDC7 (0.48) | CDC7DBF4PLK4IKBKBAURKA | |
| SCHEMBL4892342 | 0.70 | IKBKB (0.61) | IKBKBCHUK |
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-2012131297-A1 | PYRIDO [3',2' :4,5] THIENO [3, 2-D] PYRIMIDIN- 4 - YLAMINE DERIVATIVES AND THEIR THERAPEUTICAL USE | BAELL JONATHAN BAYLDON (AU) | 2012-10-04 | — | — | WO | disclosed |