Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL10936909 | 0.84 | RAPGEF4 (0.32) | ESR2 | |
| SCHEMBL5634702 | 0.82 | ACHE (0.39) | KCNA3 | |
| SCHEMBL9648712 | 0.82 | TDO2 (0.40) | ESR2TDO2GAADHFRALOX5 | |
| SCHEMBL2012945 | 0.79 | ACHE (0.39) | ESR2MGAMGAASIMGAM2 | |
| SCHEMBL9284243 | 0.79 | TDO2 (0.38) | ESR2TDO2GAADHFRALOX5 | |
| SCHEMBL8616256 | 0.79 | TDO2 (0.38) | ESR2TDO2GAADHFRALOX5 | |
| SCHEMBL16719911 | 0.79 | ALOX5 (0.49) | ESR2TDO2DHFRALOX5CA12 | |
| SCHEMBL5321259 | 0.79 | MAPK10 (0.43) | CYP1A2 | |
| SCHEMBL27707558 | 0.79 | TDO2 (0.40) | ESR2TDO2GAADHFRALOX5 | |
| SCHEMBL10939037 | 0.78 | AHR (0.35) | GAAALDH1A1CYP1A2PTGS2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113121400-A | Method for preparing 2-pyrrolidone compound | 怀化学院 | 2021-07-16 | — | — | CN | disclosed |
| CN-107501241-B | Compounds, pharmaceutical compositions containing them and their use in the treatment of proliferative diseases | 梅制药公司 | 2020-10-13 | — | — | CN | disclosed |
| US-6329135-B1 | LIGHT INSENSITIVE ORGANIC SILVER SALT ON A SUPPORT | KONICA CORPORATION (JP) | 2001-12-11 | — | — | US | disclosed |
| EP-1058151-A1 | Silver halide photothermographic material | KONICA CORPORATION (JP) | 2000-12-06 | — | — | EP | disclosed |