Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.55 |
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.54 |
| ▸ | MGLL | Q99685 | 2/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.51 |
| ▸ | CHEK2 | O96017 | 6/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765495 | 0.83 | MGLL (0.56) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL20765487 | 0.82 | HDAC6 (0.54) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL19970751 | 0.82 | BCHE (0.55) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL20765511 | 0.81 | ACACB (0.59) | MGLLMEN1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL19970807 | 0.80 | ACACB (0.62) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL20765800 | 0.80 | ALDH1A1 (0.49) | HDAC6MGLLMAPK14MEN1LMNA | |
| SCHEMBL20765523 | 0.80 | MGLL (0.58) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL20765497 | 0.79 | MGLL (0.58) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL19970885 | 0.78 | BCHE (0.56) | BCHEACHEHDAC6MGLLMAPK14 | |
| SCHEMBL19970784 | 0.77 | MGLL (0.59) | BCHEACHEHDAC6MGLLCHEK2 |
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 |