Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.43 |
| ▸ | GSK3B | P49841 | 4/20 | 0.40 |
| ▸ | GSK3A | P49840 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 5/20 | 0.37 |
| ▸ | CDK7 | P50613 | 3/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | PLK4 | O00444 | 2/20 | 0.35 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.35 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | CLK2 | P49760 | 2/20 | 0.35 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1141943 | 0.82 | MAPK1 (0.48) | MAPK1NTRK1GSK3BGSK3ACNR1 | |
| SCHEMBL3712153 | 0.81 | MAPK1 (0.46) | MAPK1NTRK1GSK3BGSK3ACNR1 | |
| SCHEMBL19100555 | 0.79 | MAPK1 (0.53) | MAPK1GSK3BGSK3AMEN1MAPT | |
| SCHEMBL15081339 | 0.79 | CDK2 (0.58) | MAPK1NTRK1GSK3BCNR1MEN1 | |
| SCHEMBL12844319 | 0.78 | PSMB8 (0.38) | MAPK1MEN1MAPTKMT2AMAP4K4 | |
| SCHEMBL16692249 | 0.76 | MAPK1 (0.48) | MAPK1GSK3BDYRK1ACYP1A2 | |
| SCHEMBL1141533 | 0.76 | GSK3B (0.48) | MAPK1NTRK1GSK3BGSK3ACDK2 | |
| SCHEMBL1141534 | 0.72 | GSK3B (0.47) | MAPK1NTRK1GSK3BGSK3ACNR1 | |
| SCHEMBL27658412 | 0.72 | GSK3B (0.47) | MAPK1NTRK1GSK3BGSK3ACDK2 | |
| SCHEMBL3771858 | 0.71 | GSK3B (0.43) | MAPK1NTRK1GSK3BGSK3ACDK2 |
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-2013099041-A1 | NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF | 富士フイルム株式会社 (JP) | 2013-07-04 | — | — | WO | disclosed |