Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | PTPRB | P23467 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LDHA | P00338 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7496453 | 0.84 | NOS2 (0.42) | ESR1ESR2L3MBTL1POLBPPARG | |
| SCHEMBL4816689 | 0.83 | ESR1 (0.63) | ESR1ESR2MIFTSHR | |
| SCHEMBL163965 | 0.83 | NOS2 (0.47) | ESR1ESR2L3MBTL1POLBPPARG | |
| SCHEMBL977403 | 0.83 | ESR1 (0.46) | ESR1ESR2PTPRBATMMIF | |
| SCHEMBL3248350 | 0.83 | L3MBTL1 (0.49) | ESR1ESR2PTPRBATMMIF | |
| SCHEMBL5672844 | 0.81 | LDHA (0.59) | SLC6A4POLBLDHAPPARGPPARA | |
| SCHEMBL3204956 | 0.81 | ATM (0.53) | ATMMIFL3MBTL1POLBALDH1A1 | |
| SCHEMBL3938449 | 0.80 | CYP4A11 (0.53) | ESR1ESR2PTPRBMIFLDHA | |
| Ammonia Solution, Strong SCHEMBL20513680 | 0.79 | ATM (0.51) | ATMMIFL3MBTL1POLBALDH1A1 | |
| Methylene Chloride SCHEMBL29038775 | 0.78 | ATM (0.50) | ATMMIFL3MBTL1POLBALDH1A1 |
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-0533933-A1 | BISHETEROCYCLIC COMPOUND | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1993-03-31 | — | — | EP | disclosed |