Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL20765463 | 0.84 | GRIN1 (0.41) | ALDH1A1GRIN1GRIN2BRAB9AHTT | |
| SCHEMBL20765464 | 0.84 | GRIN1 (0.41) | ALDH1A1GRIN1GRIN2BRAB9AHTT | |
| SCHEMBL20765784 | 0.84 | KDM4E (0.48) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765497 | 0.83 | MGLL (0.58) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765776 | 0.82 | ALDH1A1 (0.54) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765616 | 0.80 | KDM4E (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765612 | 0.80 | ALDH1A1 (0.56) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765538 | 0.79 | FGFR1 (0.57) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20774925 | 0.77 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL20765756 | 0.75 | MAPK14 (0.72) | 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 | claimed |