Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.51 |
| ▸ | PARP1 | P09874 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8809605 | 1.00 | ALDH1A1 (0.51) | ALDH1A1MAP4K4PARP1KCNH2POLB | |
| SCHEMBL8809501 | 0.99 | ALDH1A1 (0.52) | ALDH1A1MAP4K4PARP1KCNH2POLB | |
| SCHEMBL8808822 | 0.84 | HRH3 (0.64) | ALDH1A1PARP1POLBHRH3CXCR4 | |
| SCHEMBL9057097 | 0.79 | MAP4K4 (0.53) | ALDH1A1MAP4K4PARP1KCNH2POLB | |
| SCHEMBL8807206 | 0.79 | MAP4K4 (0.50) | ALDH1A1MAP4K4PARP1KCNH2POLB | |
| SCHEMBL8807848 | 0.78 | HRH3 (0.62) | ALDH1A1MAP4K4PARP1KCNH2POLB | |
| SCHEMBL9252404 | 0.77 | ALDH1A1 (0.68) | ALDH1A1PARP1KCNH2POLBHRH3 | |
| SCHEMBL11509945 | 0.77 | ALDH1A1 (0.68) | ALDH1A1PARP1KCNH2POLBHRH3 | |
| SCHEMBL8811233 | 0.77 | KCNH2 (0.56) | ALDH1A1MAP4K4PARP1KCNH2POLB | |
| SCHEMBL8809953 | 0.77 | PARP1 (0.53) | ALDH1A1MAP4K4PARP1KCNH2POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0784612-A1 | UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-07-23 | — | — | EP | disclosed |
| WO-1996010559-A1 | UREA DERIVATIVES AND THEIR USE AS ACAT-INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-04-11 | — | — | WO | disclosed |