Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16499519 | 0.82 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3AOC3GAA | |
| SCHEMBL16499484 | 0.75 | CES2 (0.35) | — | |
| SCHEMBL120187 | 0.71 | CA12 (0.58) | ALDH1A1LMNAAOC3GAATSHR | |
| SCHEMBL16499250 | 0.70 | CYP11B1 (0.37) | TSHRMAPK1 | |
| SCHEMBL16499247 | 0.69 | GAA (0.38) | GAAOPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL16499338 | 0.68 | CES2 (0.36) | — | |
| SCHEMBL16499193 | 0.68 | ALDH1A1 (0.32) | ALDH1A1SLC6A2AOC3 | |
| SCHEMBL16499296 | 0.68 | ALDH1A1 (0.47) | ALDH1A1SLC6A2SLC6A4SLC6A3LMNA | |
| SCHEMBL17236570 | 0.67 | ALDH1A1 (0.45) | ALDH1A1LMNAKMT2AAOC3GAA | |
| SCHEMBL29975972 | 0.66 | LTA4H (0.58) | ALDH1A1KMT2AAOC3GAATSHR |
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-2011155983-A1 | OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE | BIKAM PHARMACEUTICALS INC. (US) | 2011-12-15 | — | — | WO | disclosed |