Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
| ▸ | TSSK1B | Q9BXA7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765461 | 1.00 | BCHE (0.42) | BCHEACHEHRH4AGTR2HSD11B1 | |
| SCHEMBL20765524 | 0.88 | MAPK14 (0.44) | BCHEACHEHRH4AGTR2HSD11B1 | |
| SCHEMBL20765527 | 0.88 | MAPK14 (0.44) | BCHEACHEHRH4AGTR2HSD11B1 | |
| SCHEMBL20765824 | 0.84 | BCHE (0.41) | BCHEACHEHSD11B1ALDH1A1POLB | |
| SCHEMBL20765826 | 0.84 | BCHE (0.41) | BCHEACHEHSD11B1ALDH1A1POLB | |
| SCHEMBL20765553 | 0.81 | BRS3 (0.40) | BCHEACHESMN1; SMN2MAPK14 | |
| SCHEMBL20765550 | 0.81 | BRS3 (0.40) | BCHEACHESMN1; SMN2MAPK14 | |
| SCHEMBL20765611 | 0.79 | HSD11B1 (0.41) | HSD11B1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL20765609 | 0.79 | HSD11B1 (0.41) | HSD11B1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL20766168 | 0.75 | HPGD (0.43) | BCHEACHERAB9AKMT2AALDH1A1 |
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 |