Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 10/20 | 0.71 |
| ▸ | KDR | P35968 | 9/20 | 0.71 |
| ▸ | AURKB | Q96GD4 | 8/20 | 0.71 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.71 |
| ▸ | AURKA | O14965 | 2/20 | 0.71 |
| ▸ | LCK | P06239 | 2/20 | 0.71 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.71 |
| ▸ | FLT3 | P36888 | 2/20 | 0.71 |
| ▸ | SYK | P43405 | 2/20 | 0.71 |
| ▸ | INSR | P06213 | 2/20 | 0.71 |
| ▸ | MET | P08581 | 2/20 | 0.71 |
| ▸ | CDC7 | O00311 | 1/20 | 0.71 |
| ▸ | PLK4 | O00444 | 1/20 | 0.71 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.71 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.71 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.71 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.71 |
| ▸ | JAK2 | O60674 | 1/20 | 0.71 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.71 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL12952297 | 0.89 | IRAK4 (0.74) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1001618 | 0.89 | IRAK4 (0.74) | IRAK4KDRAURKBALKAURKA | |
| Hydrochloric Acid SCHEMBL1988148 | 0.88 | IRAK4 (0.73) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1002524 | 0.87 | KDR (0.68) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL3553074 | 0.87 | KDR (0.68) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1002521 | 0.87 | KDR (0.68) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1003397 | 0.87 | KDR (0.61) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1000684 | 0.87 | KDR (0.74) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1000681 | 0.87 | KDR (0.74) | IRAK4KDRAURKBALKAURKA | |
| SCHEMBL1000682 | 0.87 | KDR (0.74) | IRAK4KDRAURKBALKAURKA |
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 |
|---|---|---|---|---|---|---|---|
| US-9725419-B2 | Cycloalkyl substituted pyrimidinediamine compounds and their uses | RIGEL PHARMACEUTICALS, INC. (US) | 2017-08-08 | — | — | US | disclosed |