Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | BCHE | P06276 | 2/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL20774945 | 0.91 | MAPK14 (0.55) | MAPK14ALDH1A1NPC1SMN1; SMN2LMNA | |
| SCHEMBL20765771 | 0.90 | ALDH1A1 (0.59) | MAPK14ALDH1A1KDM4ENPC1SMN1; SMN2 | |
| SCHEMBL20765547 | 0.89 | MAPK14 (0.55) | MAPK14ALDH1A1KDM4EPOLBNPC1 | |
| SCHEMBL19970806 | 0.88 | SIGMAR1 (0.61) | MAPK14NPC1BCHEACHEMEN1 | |
| SCHEMBL20765715 | 0.86 | ALDH1A1 (0.56) | MAPK14ALDH1A1KDM4ENPC1SMN1; SMN2 | |
| SCHEMBL19970884 | 0.86 | LSS (0.54) | MAPK14ALDH1A1NPC1SMN1; SMN2LMNA | |
| SCHEMBL20782579 | 0.83 | ALDH1A1 (0.55) | MAPK14ALDH1A1KDM4EPOLBNPC1 | |
| SCHEMBL20765466 | 0.82 | ALDH1A1 (0.64) | ALDH1A1POLBMEN1TSHRKMT2A | |
| SCHEMBL19970872 | 0.82 | FAAH (0.61) | — | |
| SCHEMBL1224962 | 0.82 | FGFR1 (0.54) | MAPK14ALDH1A1KDM4EPOLB |
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 |