Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.51 |
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | SCN4A | P35499 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 2/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL25708782 | 0.84 | KIF11 (0.38) | KIF11CHUK | |
| SCHEMBL28124653 | 0.78 | GPR3 (0.54) | KIF11EPHX2SCN4A | |
| SCHEMBL11884982 | 0.76 | CYP2A6 (0.42) | DYRK1AGSK3AGSK3BCDK5PRKD3 | |
| SCHEMBL17489631 | 0.75 | SMN1; SMN2 (0.59) | LIMK1CYP1A2 | |
| SCHEMBL22373856 | 0.75 | ACHE (0.49) | — | |
| SCHEMBL24056962 | 0.75 | CHUK (0.44) | CHUKHRH4CYP1A2CSNK2A1 | |
| SCHEMBL20172151 | 0.75 | ALDH1A1 (0.34) | — | |
| SCHEMBL11884987 | 0.73 | KDM4E (0.40) | CHUKDYRK1AGSK3AGSK3BCDK5 | |
| SCHEMBL22159418 | 0.72 | MAPT (0.47) | CYP19A1LIMK1 | |
| SCHEMBL16282365 | 0.72 | KIF11 (0.39) | KIF11CHUK |
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-1954290-A2 | TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES | Merck & Co., Inc. (US) | 2008-08-13 | — | — | EP | disclosed |
| WO-2007061764-A2 | TRICYCLIC COMPOUNDS USEFUL AS INHIBITORS OF KINASES | MERCK & CO., INC. (US) | 2007-05-31 | — | — | WO | disclosed |