Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | MGLL | Q99685 | 7/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765662 | 0.89 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765612 | 0.82 | ALDH1A1 (0.56) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20782579 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765674 | 0.80 | ALDH1A1 (0.51) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20774925 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765467 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765528 | 0.79 | ALDH1A1 (0.50) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765631 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL4092885 | 0.78 | NPY5R (0.41) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765580 | 0.77 | KDM4E (0.50) | ALDH1A1KDM4ELMNAMEN1KMT2A |
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 | disclosed |