Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | BCR | P11274 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | PPARD | Q03181 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5017745 | 0.90 | MAOB (0.36) | POLBL3MBTL1MAOBMAPTCYP1A2 | |
| SCHEMBL5024168 | 0.82 | NOTUM (0.33) | — | |
| SCHEMBL5017586 | 0.81 | MAOB (0.41) | POLBL3MBTL1MAOBCYP1A2TSHR | |
| SCHEMBL5024195 | 0.79 | MAOB (0.47) | SMN1; SMN2MAOBLMNAMAPTHTT | |
| SCHEMBL5015727 | 0.79 | DPP4 (0.50) | POLBMAPK1HTTPDCD1LG2CD274 | |
| SCHEMBL5025721 | 0.76 | MAOB (0.37) | POLBHPGDMAOBLMNAGAA | |
| SCHEMBL5017759 | 0.76 | MAOB (0.37) | POLBHPGDMAOBLMNAGAA | |
| SCHEMBL5024304 | 0.74 | DPP4 (0.44) | MAPK1CYP1A2PDCD1LG2CD274MEN1 | |
| SCHEMBL5015642 | 0.74 | TACR3 (0.41) | POLBHPGDLMNAMAPTPDCD1LG2 | |
| SCHEMBL5025797 | 0.71 | ALDH1A1 (0.36) | LMNAGAATSHR |
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 | disclosed |
| WO-2007008502-A2 | INHIBITORS OF CHECKPOINT KINASES | MERCK & CO., INC. (US) | 2007-01-18 | — | — | WO | disclosed |