Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6824190 | 0.96 | MAPK14 (0.43) | KDM4EGAACDK1CDK2MAPK14 | |
| SCHEMBL6823887 | 0.88 | CDK2 (0.37) | KDM4EGAACDK1CDK2MAPK14 | |
| SCHEMBL6821385 | 0.88 | MAPK14 (0.34) | CDK1CDK2MAPK14CASP7CASP6 | |
| SCHEMBL6824291 | 0.86 | CDK1 (0.36) | CDK1CDK2MAPK14 | |
| SCHEMBL6923124 | 0.85 | CDK1 (0.53) | CDK1CDK2MAPK14ALDH1A1NPC1 | |
| SCHEMBL6920876 | 0.85 | KMT2A (0.33) | KDM4EGAAPKMCDK1CDK2 | |
| SCHEMBL6824690 | 0.85 | IKBKB (0.35) | GAACDK1CDK2ALDH1A1NPC1 | |
| SCHEMBL6826381 | 0.85 | MAPK14 (0.39) | KDM4EGAAPKMCDK1CDK2 | |
| SCHEMBL6824151 | 0.84 | IKBKB (0.34) | GAACDK1CDK2ALDH1A1NPC1 | |
| SCHEMBL6820704 | 0.84 | CDK1 (0.59) | KDM4ECDK1CDK2MAPK14ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | claimed |
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |