Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12505329 | 0.86 | MAPT (0.44) | ALDH1A1NPSR1MAPTHTTRAB9A | |
| SCHEMBL5058985 | 0.75 | TSHR (0.43) | ALDH1A1CYP1A2CYP2C19HTTTSHR | |
| SCHEMBL5055796 | 0.75 | TSHR (0.43) | ALDH1A1CYP1A2CYP2C19HTTTSHR | |
| SCHEMBL20210327 | 0.74 | TSHR (0.41) | ALDH1A1CYP1A2CYP2C19NPSR1MAPT | |
| SCHEMBL529539 | 0.72 | MAPT (0.44) | ALDH1A1GAANPSR1MAPTMEN1 | |
| SCHEMBL529873 | 0.72 | LMNA (0.48) | ALDH1A1GAANPSR1MAPTHTT | |
| SCHEMBL12367733 | 0.71 | TSHR (0.54) | ALDH1A1NPSR1MAPTRAB9ATSHR | |
| SCHEMBL21101926 | 0.71 | LMNA (0.42) | ALDH1A1NPSR1MAPTHTTMAPK1 | |
| SCHEMBL12169725 | 0.71 | CA1 (0.47) | ALDH1A1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL22182885 | 0.70 | KIF11 (0.40) | ALDH1A1MAPTKMT2ARAB9ATSHR |
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-2012014127-A1 | 5-LIPOXYGENASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-02-02 | — | — | WO | claimed |