Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SCN1A | P35498 | 1/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.40 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5122891 | 1.00 | ALDH1A1 (0.52) | ALDH1A1ENPP2EPHX1MEN1KMT2A | |
| SCHEMBL5123960 | 1.00 | ALDH1A1 (0.52) | ALDH1A1ENPP2EPHX1MEN1KMT2A | |
| SCHEMBL1799143 | 0.93 | ENPP2 (0.52) | ALDH1A1ENPP2EPHX1MEN1KMT2A | |
| SCHEMBL5981283 | 0.93 | ENPP2 (0.52) | ALDH1A1ENPP2EPHX1MEN1KMT2A | |
| SCHEMBL7033170 | 0.93 | ENPP2 (0.52) | ALDH1A1ENPP2EPHX1MEN1KMT2A | |
| SCHEMBL7275332 | 0.87 | ENPP2 (0.49) | ALDH1A1ENPP2EPHX1MEN1KMT2A | |
| SCHEMBL7382258 | 0.87 | ALDH1A1 (0.46) | ALDH1A1ENPP2KMT2ASIGMAR1GAA | |
| SCHEMBL27556768 | 0.82 | ENPP2 (0.45) | ENPP2SIGMAR1CTSK | |
| SCHEMBL4420999 | 0.82 | ENPP2 (0.45) | ENPP2SIGMAR1CTSK | |
| SCHEMBL7375518 | 0.81 | SIGMAR1 (0.44) | ALDH1A1ENPP2MEN1KMT2ASIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1897931-A | Inhibitors of cathepsin s | IRM LLC (BM) | 2007-01-17 | — | — | CN | disclosed |