Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.43 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5017853 | 0.95 | METAP2 (0.43) | METAP2FYNMAPK8PDE1APDE1B | |
| SCHEMBL5024275 | 0.82 | LIMK1 (0.41) | FYNKDM4EALDH1A1HPGD | |
| SCHEMBL5024158 | 0.77 | TP53 (0.41) | KDM4EHSD17B10 | |
| SCHEMBL4294729 | 0.76 | CHEK1 (0.54) | METAP2FYNMAPK8CHUKINSR | |
| SCHEMBL5017849 | 0.74 | SETD7 (0.44) | MAPK8PDE1APDE1BPDE4DPDE7A | |
| SCHEMBL5025775 | 0.74 | HSD17B1 (0.45) | KDM4EMEN1KMT2AALDH1A1HSD17B10 | |
| SCHEMBL5024319 | 0.74 | CD274 (0.42) | HPGD | |
| SCHEMBL5024099 | 0.73 | HPGD (0.41) | PARP1KDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL5017584 | 0.73 | NOS3 (0.35) | METAP2HDAC1 | |
| SCHEMBL5017431 | 0.72 | EPRS1 (0.43) | HSD17B10 |
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-1904449-A2 | INHIBITORS OF CHECKPOINT KINASES | Merck & Co., Inc. (US) | 2008-04-02 | — | — | EP | claimed |
| WO-2007008502-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2007-01-18 | — | — | WO | claimed |