Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29800427 | 0.78 | CA12 (0.56) | CYP1A2LMNACYP3A4MAOANPC1 | |
| SCHEMBL811649 | 0.78 | CA12 (0.56) | CYP1A2LMNACYP3A4MAOANPC1 | |
| SCHEMBL28779574 | 0.77 | MKNK1 (0.46) | CYP1A2LMNACYP3A4MAOANPC1 | |
| SCHEMBL2215985 | 0.77 | SMN1; SMN2 (0.43) | CYP1A2LMNACYP3A4MAOANPC1 | |
| SCHEMBL6178023 | 0.75 | ALDH1A1 (0.49) | NPC1RAB9ASMN1; SMN2CA12CA1 | |
| SCHEMBL3159422 | 0.74 | ALDH1A1 (0.50) | CYP1A2LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5964500 | 0.74 | OXTR (0.48) | CYP1A2NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL4651619 | 0.74 | CYP1A2 (0.47) | CYP1A2LMNACYP3A4MAOANPC1 | |
| SCHEMBL1222552 | 0.73 | NPC1 (0.62) | CYP1A2LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7930158 | 0.73 | LMNA (0.53) | CYP1A2LMNACYP3A4MAOANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1638964-B1 | NOVEL COMPOUNDS THAT MODULATE PPAR-GAMMA TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS | GALDERMA RES & DEV (FR) | 2011-07-27 | — | — | EP | disclosed |