Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 10/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.47 |
| ▸ | PRMT5 | O14744 | 3/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16150702 | 0.83 | CHEK2 (0.56) | CHEK2PRMT5HTR2BHDAC4 | |
| SCHEMBL13290557 | 0.81 | KMT2A (0.51) | CHEK2HDAC4 | |
| SCHEMBL1552726 | 0.80 | CHEK2 (0.87) | CHEK2GPR119 | |
| SCHEMBL20765578 | 0.80 | LSS (0.50) | CHEK2HTTHTR2BGSK3AGSK3B | |
| SCHEMBL20765771 | 0.79 | ALDH1A1 (0.59) | CHEK2HTT | |
| SCHEMBL28494646 | 0.79 | MEN1 (0.67) | HTTGPR119HDAC4 | |
| SCHEMBL12392575 | 0.78 | CHEK2 (0.58) | CHEK2HTT | |
| SCHEMBL5951725 | 0.78 | CHEK1 (0.47) | CHEK2GSK3AGSK3B | |
| SCHEMBL1551760 | 0.77 | CHEK2 (0.88) | CHEK2 | |
| SCHEMBL17390000 | 0.77 | FASN (0.63) | CHEK2HTR2B |
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-2019038683-A1 | COMPOUNDS TARGETING TANDEM BRCT DOMAINS OF BRCA1, COMPOSITIONS AND METHODS THEREOF | INSTITUTE FOR STEM CELL BIOLOGY AND REGENERATIVE MEDICINE (IN) | 2019-02-28 | — | — | WO | claimed |
| WO-2019038683-A1 | COMPOUNDS TARGETING TANDEM BRCT DOMAINS OF BRCA1, COMPOSITIONS AND METHODS THEREOF | INSTITUTE FOR STEM CELL BIOLOGY AND REGENERATIVE MEDICINE (IN) | 2019-02-28 | — | — | WO | disclosed |