Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE2 | O96020 | 1/20 | 0.50 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | VNN1 | O95497 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PRUNE1 | Q86TP1 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12482022 | 0.91 | MAPT (0.48) | CCNE2CCNE1CDK2POLBVNN1 | |
| SCHEMBL12481763 | 0.91 | CCNE2 (0.50) | CCNE2CCNE1CDK2POLBVNN1 | |
| SCHEMBL2064402 | 0.84 | LMNA (0.53) | POLBVNN1ALDH1A1MAPTKDM4E | |
| SCHEMBL28462667 | 0.82 | CCNE1 (0.51) | CCNE2CCNE1CDK2ALDH1A1L3MBTL1 | |
| SCHEMBL28462688 | 0.81 | HRH4 (0.59) | CCNE2CCNE1CDK2PDE5A | |
| SCHEMBL28463716 | 0.81 | RAB9A (0.48) | CCNE2CCNE1CDK2ALDH1A1MAPT | |
| SCHEMBL15619030 | 0.76 | CCNE2 (0.68) | CCNE2CCNE1CDK2POLBMAPT | |
| SCHEMBL23828407 | 0.76 | MAPT (0.47) | POLBVNN1NPSR1ALDH1A1MAPT | |
| SCHEMBL28460443 | 0.74 | ALDH1A1 (0.38) | POLBALDH1A1MAPTNPC1KDM4E | |
| SCHEMBL25919415 | 0.73 | ADORA2A (0.46) | CCNE2CCNE1CDK2VNN1NPSR1 |
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-109438447-B | Preparation method and application of 5, 7-dihydro-6H-pyrrolo [2,3-d ] pyrimidine-6-ketone derivative | 北京工业大学 | 2020-10-16 | — | — | CN | disclosed |