Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL120165 | 0.83 | ERN1 (0.44) | MAOBCYP2A6ALDH1A1TP53HPGD | |
| SCHEMBL5746295 | 0.76 | SLC22A12 (0.46) | MAOBMAOACYP2A6F2RL3SLC22A12 | |
| SCHEMBL13202363 | 0.75 | MAOB (0.51) | MAOBMAOAF2RL3SLC22A12ALDH1A1 | |
| SCHEMBL5828926 | 0.73 | NFE2L2 (0.49) | MAOBMAOAALDH1A1TP53HPGD | |
| SCHEMBL5828924 | 0.73 | NFE2L2 (0.49) | MAOBMAOAALDH1A1TP53HPGD | |
| SCHEMBL11746052 | 0.72 | PIM1 (0.61) | MAOBMAOAF2RL3SLC22A12ALDH1A1 | |
| SCHEMBL4130113 | 0.72 | LMNA (0.51) | MAOBMAOAF2RL3SLC22A12ALDH1A1 | |
| SCHEMBL29985195 | 0.71 | APP (0.60) | MAOBCYP2A6ALDH1A1HPGDAPP | |
| SCHEMBL120294 | 0.71 | APP (0.60) | MAOBCYP2A6ALDH1A1HPGDAPP | |
| SCHEMBL5829219 | 0.71 | PIM1 (0.46) | MAOBMAOAF2RL3SLC22A12ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7094798-B1 | Inhibitors of checkpoint kinases (Wee1 and Chk1) | PFIZER INC (US) | 2006-08-22 | — | — | US | disclosed |
| EP-1501831-A1 | INHIBITORS OF CHECKPOINT KINASES (WEE1 AND CHK1) | WARNER-LAMBERT COMPANY LLC (US) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003091255-A1 | INHIBITORS OF CHECKPOINT KINASES (WEE1 AND CHK1) | WARNER-LAMBERT COMPANY LLC (US) | 2003-11-06 | — | — | WO | disclosed |