Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL31187732 | 0.79 | L3MBTL1 (0.48) | GAAGPR139KMT2ACES2CES1 | |
| SCHEMBL31359082 | 0.79 | L3MBTL1 (0.48) | GAAGPR139KMT2ACES2CES1 | |
| SCHEMBL26896061 | 0.77 | CES2 (0.45) | ALDH1A1CYP2C19GPR139CYP1A2KMT2A | |
| SCHEMBL8300134 | 0.76 | CES2 (0.44) | ALDH1A1GPR139KMT2ACES2CES1 | |
| SCHEMBL23123653 | 0.74 | GPR139 (0.49) | ALDH1A1CYP2C19GPR139CYP3A4KMT2A | |
| SCHEMBL29757886 | 0.74 | GPR139 (0.49) | ALDH1A1CYP2C19GPR139CYP3A4KMT2A | |
| SCHEMBL23123650 | 0.74 | GPR139 (0.49) | ALDH1A1CYP2C19GPR139CYP3A4KMT2A | |
| SCHEMBL5644652 | 0.71 | NPC1 (0.51) | ALDH1A1GAAGPR139KMT2AMEN1 | |
| SCHEMBL17041588 | 0.71 | TRPA1 (0.44) | GPR139KMT2ACES2CES1PPARG | |
| SCHEMBL6895432 | 0.71 | ALDH1A1 (1.00) | ALDH1A1CYP2C19GAACYP1A2CYP3A4 |
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-2008124518-A1 | OXO-DIHYDROISOINDOLE SULFONAMIDE COMPOUNDS AS MODULATORS OF THE CCK2 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-10-16 | — | — | WO | disclosed |