Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 10/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GCK | P35557 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL2835830 | 0.87 | CASR (0.66) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL2838847 | 0.87 | CASR (0.55) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL2839722 | 0.83 | TSHR (0.46) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL4147810 | 0.80 | CASR (0.56) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL3345000 | 0.80 | CASR (0.60) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL2858671 | 0.78 | BRD4 (0.43) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL4144136 | 0.78 | CASR (0.51) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL2839694 | 0.77 | CYP1A2 (0.43) | CASRNR1I2ALDH1A1CYP1A2TSHR | |
| SCHEMBL2843300 | 0.76 | CASR (0.52) | CASRNR1I2 | |
| SCHEMBL2838115 | 0.76 | CASR (0.55) | CASRALDH1A1CYP1A2TSHRCYP3A4 |
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-2010039913-A1 | CALCILYTIC COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-04-08 | — | — | WO | disclosed |