Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 2/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765824 | 1.00 | BCHE (0.41) | BCHEACHECHEK2PPARDPPARG | |
| SCHEMBL20765488 | 0.88 | CCR1 (0.44) | BCHEACHECHEK2ALDH1A1KDM4E | |
| SCHEMBL20765484 | 0.88 | CCR1 (0.44) | BCHEACHECHEK2ALDH1A1KDM4E | |
| SCHEMBL20765458 | 0.84 | BCHE (0.42) | BCHEACHEALDH1A1POLBHSD11B1 | |
| SCHEMBL20765461 | 0.84 | BCHE (0.42) | BCHEACHEALDH1A1POLBHSD11B1 | |
| SCHEMBL20765553 | 0.84 | BRS3 (0.40) | BCHEACHEHDAC1FGFR1FGFR2 | |
| SCHEMBL20765550 | 0.84 | BRS3 (0.40) | BCHEACHEHDAC1FGFR1FGFR2 | |
| SCHEMBL20765611 | 0.77 | HSD11B1 (0.41) | ALDH1A1KDM4EPOLBHSD11B1 | |
| SCHEMBL20765609 | 0.77 | HSD11B1 (0.41) | ALDH1A1KDM4EPOLBHSD11B1 | |
| SCHEMBL20765622 | 0.76 | BCHE (0.46) | BCHEACHECHEK2PPARDPPARG |
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 |