Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 10/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765598 | 1.00 | CHEK2 (0.42) | CHEK2DRD2DRD3KDM4ENPC1 | |
| SCHEMBL20765470 | 0.92 | BCHE (0.39) | CHEK2KDM4EALDH1A1 | |
| SCHEMBL20765530 | 0.88 | FGFR1 (0.44) | CHEK2 | |
| SCHEMBL20765533 | 0.88 | FGFR1 (0.44) | CHEK2 | |
| SCHEMBL20765618 | 0.87 | ALDH1A1 (0.40) | DRD2DRD3ALDH1A1POLB | |
| SCHEMBL20765619 | 0.87 | ALDH1A1 (0.40) | DRD2DRD3ALDH1A1POLB | |
| SCHEMBL20765519 | 0.85 | MEN1 (0.38) | KDM4EALDH1A1PKM | |
| SCHEMBL20765521 | 0.85 | MEN1 (0.38) | KDM4EALDH1A1PKM | |
| SCHEMBL20765462 | 0.81 | IDH1 (0.37) | KDM4EALDH1A1PKM | |
| SCHEMBL20765465 | 0.81 | IDH1 (0.37) | KDM4EALDH1A1PKM |
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-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 |