Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 6/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NCOA2 | Q15596 | 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 | |
|---|---|---|---|---|
| SCHEMBL18609641 | 0.92 | CASR (0.39) | CASRTP53MAPTPOLBNPC1 | |
| SCHEMBL18609489 | 0.87 | ROCK1 (0.38) | CASRTP53MAPTPOLBALDH1A1 | |
| SCHEMBL18609943 | 0.84 | POLB (0.41) | CASRTP53MAPTPOLBNPC1 | |
| SCHEMBL18609640 | 0.79 | ROCK1 (0.36) | CASRMAPTPOLB | |
| SCHEMBL18610128 | 0.78 | SMN1; SMN2 (0.42) | CASRMAPTPOLBLMNAHTT | |
| SCHEMBL18609844 | 0.74 | CASR (0.39) | CASRPOLBLMNAHTT | |
| SCHEMBL18610124 | 0.73 | ROCK1 (0.37) | CASRTP53MAPTPOLBBCHE | |
| SCHEMBL18610308 | 0.73 | ROCK1 (0.42) | MAPTPOLBPPARG | |
| SCHEMBL18609918 | 0.72 | LMNA (0.47) | CASRMAPTMAPK14LMNAHTT | |
| SCHEMBL18609805 | 0.71 | LTB4R (0.40) | CASR |
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 |