Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY1R | P25929 | 1/20 | 0.44 |
| ▸ | NPY2R | P49146 | 1/20 | 0.44 |
| ▸ | LSS | P48449 | 6/20 | 0.42 |
| ▸ | PTGES | O14684 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | THRA | P10827 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.37 |
| ▸ | PLK1 | P53350 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | NR5A1 | Q13285 | 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 | |
|---|---|---|---|---|
| SCHEMBL3369705 | 0.88 | LSS (0.54) | LSS | |
| SCHEMBL7176866 | 0.79 | PTGES (0.52) | PTGES | |
| SCHEMBL7207718 | 0.76 | NPY1R (0.41) | NPY1RNPY2RLSS | |
| SCHEMBL3367508 | 0.70 | LSS (0.51) | LSSPTGES | |
| SCHEMBL7169877 | 0.69 | THRA (0.51) | LSSTHRATHRBNR5A1 | |
| SCHEMBL7166938 | 0.69 | THRA (0.51) | LSSTHRATHRBNR5A1 | |
| SCHEMBL3369726 | 0.69 | LSS (0.52) | LSSPTGES | |
| SCHEMBL5452892 | 0.68 | NR5A1 (0.54) | PTGESNPC1THRATHRBNR5A1 | |
| SCHEMBL7165071 | 0.67 | THRA (0.47) | LSSTHRATHRB | |
| SCHEMBL16968358 | 0.67 | NR5A1 (0.56) | LSSNPC1THRATHRBNR5A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1303503-A2 | ANILINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-04-23 | — | — | EP | disclosed |
| WO-2002006189-A2 | ANILINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-01-24 | — | — | WO | disclosed |