Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKD3 | O94806 | 2/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.45 |
| ▸ | AKT2 | P31751 | 2/20 | 0.45 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.45 |
| ▸ | PBK | Q96KB5 | 2/20 | 0.45 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.45 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.45 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.45 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.35 |
| ▸ | CDK1 | P06493 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.35 |
| ▸ | PLK4 | O00444 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.35 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4598143 | 0.83 | SRC (0.41) | PRKD3MAP4K4AKT2PIM3PBK | |
| SCHEMBL4900221 | 0.74 | MAPKAPK2 (0.47) | PRKD3MAP4K4AKT2PIM3PBK | |
| SCHEMBL4897972 | 0.74 | MAPKAPK2 (0.47) | PRKD3MAP4K4AKT2PIM3PBK | |
| SCHEMBL1229059 | 0.68 | ROCK2 (0.49) | PRKD3MAP4K4AKT2PIM3PBK | |
| SCHEMBL1228817 | 0.67 | JAK2 (0.34) | PRKD3MAP4K4AKT2PIM3PBK | |
| SCHEMBL4898767 | 0.66 | RPS6KB1 (0.40) | PRKD3MAP4K4AKT2PIM3PBK | |
| SCHEMBL4598151 | 0.64 | OPRK1 (0.38) | AKT2ROCK2ROCK1RPS6KB1AURKB | |
| SCHEMBL4598401 | 0.63 | KDR (0.47) | RPS6KB1AURKBKDRMAPTNLRP3 | |
| SCHEMBL10806200 | 0.63 | TERT (0.48) | CDK1GSK3BCCNB2CCNB1CCNB3 | |
| SCHEMBL4908137 | 0.63 | ROCK1 (0.52) | PRKD3MAP4K4AKT2PIM3PBK |
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-1910312-A1 | QUADRATIC ACID II DERIVATIVES | Merck Patent GmbH (DE) | 2008-04-16 | — | — | EP | claimed |
| WO-2007014608-A1 | QUADRATIC ACID II DERIVATIVES | MERCK PATENT GMBH (DE) | 2007-02-08 | — | — | WO | claimed |