Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.46 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SYK | P43405 | 2/20 | 0.34 |
| ▸ | CTSC | P53634 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | BRD2 | P25440 | 1/20 | 0.32 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.31 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 2/20 | 0.31 |
| ▸ | AKT1 | P31749 | 2/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4595017 | 0.91 | CYP11B1 (0.41) | KIF11CYP11B1CYP11B2TDP2SYK | |
| SCHEMBL4898275 | 0.86 | KIF11 (0.48) | KIF11TDP2CHRNB2CHRNA4PDE3B | |
| SCHEMBL4596312 | 0.84 | KIF11 (0.63) | KIF11CYP11B1CYP11B2TDP2CHRNB2 | |
| SCHEMBL4596036 | 0.71 | KIF11 (0.45) | KIF11TDP2CHRNB2CHRNA4BRD4 | |
| SCHEMBL19187758 | 0.71 | CYP11B1 (0.60) | KIF11CYP11B1CYP11B2SYKCTSC | |
| SCHEMBL4596871 | 0.69 | KIF11 (0.59) | KIF11CYP11B1CYP11B2TDP2CHRNB2 | |
| SCHEMBL4596644 | 0.69 | KIF11 (0.70) | KIF11CYP11B1CYP11B2TDP2PDE3B | |
| SCHEMBL4596437 | 0.69 | KIF11 (0.65) | KIF11CYP11B1CYP11B2TDP2CHRNB2 | |
| SCHEMBL1903306 | 0.67 | KIF11 (0.80) | KIF11CYP11B1CYP11B2TDP2PDE3B | |
| SCHEMBL2054589 | 0.67 | CYP11B1 (0.48) | KIF11CYP11B1CYP11B2SYKPDE3B |
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-1874753-A2 | COMPOUNDS, COMPOSITIONS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113432-A2 | COMPOUNDS, COMPOSITIONS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |