Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YAP1 | P46937 | 13/20 | 0.45 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.42 |
| ▸ | ACE | P12821 | 2/20 | 0.42 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3451041 | 0.92 | ALDH1A1 (0.43) | CALCRL | |
| SCHEMBL6015065 | 0.92 | ALDH1A1 (0.43) | CALCRL | |
| SCHEMBL3450767 | 0.89 | FPR2 (0.45) | YAP1CACNA1B | |
| SCHEMBL6015142 | 0.85 | FPR2 (0.42) | YAP1CALCRL | |
| SCHEMBL6015116 | 0.83 | CYP51A1 (0.42) | ACECALCRL | |
| SCHEMBL6015112 | 0.80 | CCR1 (0.38) | — | |
| SCHEMBL3449290 | 0.80 | FPR2 (0.49) | — | |
| SCHEMBL3449020 | 0.80 | FPR2 (0.49) | — | |
| SCHEMBL3448805 | 0.80 | FPR2 (0.49) | — | |
| SCHEMBL3449487 | 0.79 | MAPT (0.37) | YAP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1695961-A1 | UREA DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE | Takeda Pharmaceutical Company Limited (JP) | 2006-08-30 | — | — | EP | disclosed |