Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 2/20 | 0.43 |
| ▸ | PRKCI | P41743 | 1/20 | 0.42 |
| ▸ | CTSA | P10619 | 1/20 | 0.40 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 4/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | KDM4B | O94953 | 1/20 | 0.36 |
| ▸ | KDM5C | P41229 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2303493 | 0.80 | KAT6A (0.55) | CHEK2PRKCIKAT6ALRRK2FYN | |
| SCHEMBL5608592 | 0.78 | CHEK2 (0.46) | CHEK2CTSAKAT6AMYCNTRK1 | |
| SCHEMBL30810276 | 0.76 | PARP1 (0.45) | CHEK2MYCHDAC2AURKAPDPK1 | |
| SCHEMBL27664694 | 0.73 | CHEK2 (0.53) | CHEK2CTSAMYCHDAC2KDM4B | |
| SCHEMBL3147421 | 0.71 | PDPK1 (0.42) | CHEK2CTSAKAT6AHDAC2HPGD | |
| SCHEMBL27744970 | 0.71 | TYK2 (0.41) | CHEK2HDAC2AURKAPDPK1RPS6KB1 | |
| SCHEMBL30810193 | 0.71 | HPGD (0.42) | CHEK2MYCHPGDAURKAPDPK1 | |
| SCHEMBL2857991 | 0.70 | KAT6A (0.49) | CHEK2PRKCICTSAKAT6AFYN | |
| SCHEMBL5608597 | 0.70 | SIRT2 (0.55) | HPGDMAPK1MAPK8 | |
| 2-Phenylthiazole SCHEMBL5968560 | 0.70 | PDPK1 (0.68) | CHEK2KAT6AMYCHDAC2PDPK1 |
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-1805132-A2 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-07-11 | — | — | EP | disclosed |
| WO-2006110173-A2 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-19 | — | — | WO | disclosed |