Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.46 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 3/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | MMP12 | P39900 | 2/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | MMP14 | P50281 | 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 | |
|---|---|---|---|---|
| SCHEMBL6533560 | 0.85 | CHRM5 (0.53) | ALDH1A1LPAR1CHRM5CHRM1CHRM3 | |
| SCHEMBL4938946 | 0.74 | MTNR1A (0.51) | ALDH1A1FFAR1FFAR4PPARA | |
| SCHEMBL10896138 | 0.73 | TP53 (0.43) | ALDH1A1LTB4R2 | |
| SCHEMBL4216332 | 0.72 | MMP2 (0.62) | ALDH1A1FFAR1FFAR4LPAR1PTGDR2 | |
| SCHEMBL10900226 | 0.70 | TSHR (0.39) | ALDH1A1PPARA | |
| SCHEMBL10987249 | 0.69 | ALDH1A1 (0.50) | ALDH1A1LTB4R2 | |
| SCHEMBL17940806 | 0.69 | FFAR1 (0.56) | FFAR1FFAR4LPAR1PPARAPTGDR2 | |
| SCHEMBL7596724 | 0.69 | FFAR1 (0.52) | FFAR1FFAR4PPARAPTGDR2MMP2 | |
| SCHEMBL6778364 | 0.68 | PTGES (0.56) | ALDH1A1LPAR1LTB4R2BACE1 | |
| SCHEMBL6716281 | 0.68 | AOC3 (0.50) | ALDH1A1CHRM1CHRM3 |
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-2005042491-A1 | BENZAZEPINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES | ARENA PHARMACEUTICALS, INC. (US) | 2005-05-12 | — | — | WO | disclosed |