Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.36 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6820704 | 0.86 | CDK1 (0.59) | CDK1CDK2MAPK14ALDH1A1HPGD | |
| SCHEMBL6923124 | 0.85 | CDK1 (0.53) | CDK1CDK2L3MBTL1MAPK14ALDH1A1 | |
| SCHEMBL6824305 | 0.81 | MAPK14 (0.48) | CDK1CDK2MAPK14ALDH1A1HPGD | |
| SCHEMBL6826440 | 0.81 | CDK1 (0.55) | CDK1CDK2ALDH1A1LMNAHPGD | |
| SCHEMBL6824190 | 0.80 | MAPK14 (0.43) | CDK1CDK2L3MBTL1MAPK14ALDH1A1 | |
| SCHEMBL6826271 | 0.79 | KDM4E (0.41) | CDK1CDK2MAPK14ALDH1A1SMN1; SMN2 | |
| SCHEMBL6824361 | 0.79 | MAPK14 (0.40) | CDK1CDK2MAPK14ALDH1A1LMNA | |
| SCHEMBL6826381 | 0.78 | MAPK14 (0.39) | CDK1CDK2L3MBTL1MAPK14ALDH1A1 | |
| SCHEMBL6824771 | 0.77 | CDK1 (0.38) | CDK1CDK2ALDH1A1HPGD | |
| SCHEMBL6821420 | 0.77 | CDK1 (0.43) | CDK1CDK2MAPK14 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |