Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | WDR5 | P61964 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18609490 | 0.92 | CASR (0.40) | CASRMAPTTP53POLBNPC1 | |
| SCHEMBL18609640 | 0.87 | ROCK1 (0.36) | CASRMAPTPOLB | |
| SCHEMBL18609943 | 0.86 | POLB (0.41) | CASRMAPTTP53POLBNPC1 | |
| SCHEMBL18610128 | 0.85 | SMN1; SMN2 (0.42) | CASRMAPTPOLBLMNA | |
| SCHEMBL18609844 | 0.83 | CASR (0.39) | CASRPOLBLMNA | |
| SCHEMBL18609489 | 0.79 | ROCK1 (0.38) | CASRMAPTTP53POLBALDH1A1 | |
| SCHEMBL18609838 | 0.75 | ALDH1A1 (0.40) | CASRMAPTTP53POLBALDH1A1 | |
| SCHEMBL18610296 | 0.74 | ROCK1 (0.36) | CASRMAPTTP53POLBBCHE | |
| SCHEMBL18609942 | 0.72 | ROCK1 (0.41) | MAPTTP53POLB | |
| SCHEMBL18610126 | 0.72 | LTB4R (0.38) | CASRMAPTTP53ALDH1A1 |
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-2017037616-A1 | ARYLALKYLAMINE COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS | LUPIN LIMITED (IN) | 2017-03-09 | — | — | WO | disclosed |