Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PPARA | Q07869 | 7/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 5/20 | 0.40 |
| ▸ | FABP2 | P12104 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7311896 | 0.85 | MMP1 (0.50) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL727827 | 0.81 | CA1 (0.43) | ALDH1A1MAPTSLC22A12LMNAFFAR1 | |
| SCHEMBL11540004 | 0.81 | MAOA (0.40) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL951931 | 0.81 | TBXA2R (0.41) | PPARAMIFSLC22A12TSHRLMNA | |
| SCHEMBL11538993 | 0.80 | PPARA (0.51) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL7302768 | 0.80 | MAPT (0.45) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL13969489 | 0.80 | MAOA (0.41) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL11507140 | 0.77 | MIF (0.54) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL21991844 | 0.77 | PPARA (0.56) | ALDH1A1PPARACYP1A2CYP3A4MEN1 | |
| SCHEMBL13945735 | 0.76 | MAOA (0.47) | ALDH1A1PPARACYP1A2CYP3A4MEN1 |
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-0780386-B1 | Matrix metalloprotease inhibitors | HOFFMANN LA ROCHE (CH) | 2002-10-02 | — | — | EP | disclosed |
| EP-0780386-A1 | Matrix metalloprotease inhibitors | F. HOFFMANN-LA ROCHE AG (CH) | 1997-06-25 | — | — | EP | disclosed |