Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 9/20 | 0.42 |
| ▸ | CDK1 | P06493 | 8/20 | 0.42 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CDC7 | O00311 | 3/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.36 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.36 |
| ▸ | JAK2 | O60674 | 4/20 | 0.36 |
| ▸ | PRKCG | P05129 | 2/20 | 0.35 |
| ▸ | PRKACA | P17612 | 2/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6826600 | 0.80 | CDK1 (0.53) | CDK2CDK1CCNE1CDK5CDK5R1 | |
| SCHEMBL6826746 | 0.78 | CDK1 (0.44) | CDK2CDK1CDC7CCNE1DBF4 | |
| SCHEMBL7067140 | 0.78 | CDK2 (0.46) | CDK2CDK1HSD17B14CDC7CCNE1 | |
| SCHEMBL6921150 | 0.78 | CDK1 (0.41) | CDK2CDK1MEN1MAPTKMT2A | |
| SCHEMBL6824620 | 0.75 | CDK1 (0.49) | CDK2CDK1NPC1MAPTHPGD | |
| SCHEMBL6915719 | 0.74 | DYRK1A (0.49) | CDK2CDK1MEN1NPC1KMT2A | |
| SCHEMBL6922661 | 0.73 | CDK2 (0.51) | CDK2CDK1MEN1NPC1ALDH1A1 | |
| SCHEMBL6823684 | 0.73 | CDK2 (0.47) | CDK2CDK1CDC7CCNE1DBF4 | |
| SCHEMBL6823862 | 0.73 | HDAC8 (0.42) | CDK2HSD17B14JAK2CDK9RPS6KA3 | |
| SCHEMBL6920709 | 0.71 | HSP90AA1 (0.49) | CDK2CDK1MEN1MAPTKMT2A |
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 |