Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.37 |
| ▸ | PAK4 | O96013 | 1/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28953540 | 1.00 | KDR (0.46) | KDRKDM4ESMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL21163791 | 0.91 | CYP1A2 (0.46) | KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL29808731 | 0.89 | HTR3E (0.46) | KDM4ESMN1; SMN2APPMAP4K4LMNA | |
| SCHEMBL29808763 | 0.89 | NTRK1 (0.44) | KDM4ESMN1; SMN2ALDH1A1HPGDLMNA | |
| SCHEMBL28845395 | 0.89 | HTR3E (0.46) | KDM4ESMN1; SMN2APPMAP4K4LMNA | |
| SCHEMBL21163838 | 0.89 | NTRK1 (0.44) | KDM4ESMN1; SMN2ALDH1A1HPGDLMNA | |
| SCHEMBL21164017 | 0.88 | ROCK1 (0.45) | KDRKDM4ESMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL29808756 | 0.88 | ROCK1 (0.45) | KDRKDM4ESMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL21163789 | 0.87 | ROCK1 (0.50) | KDRSMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL29808696 | 0.87 | ROCK1 (0.50) | KDRSMN1; SMN2ALDH1A1HSD17B10TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-111065635-B | Novel pyrimidine derivatives as MTH1 inhibitors | 无锡安万生物科技有限公司 | 2022-07-22 | — | — | CN | disclosed |