Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 4/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 6/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CETP | P11597 | 2/20 | 0.32 |
| ▸ | LIPE | Q05469 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12323306 | 0.83 | ESR1 (0.42) | NR1I2ESR1ESR2CYP4F2CYP4A11 | |
| SCHEMBL14593355 | 0.82 | ESR1 (0.48) | NR1I2ESR1ESR2CYP4F2CYP4A11 | |
| SCHEMBL5013584 | 0.81 | ESR1 (0.36) | NR1I2ESR1ESR2CYP4F2CYP4A11 | |
| SCHEMBL5865851 | 0.79 | TSHR (0.45) | NR1I2ESR1ESR2CYP4F2CYP4A11 | |
| SCHEMBL7370695 | 0.79 | LOXL2 (0.43) | NR1I2ESR1ESR2CYP4F2CYP4A11 | |
| SCHEMBL18103202 | 0.79 | PTPN5 (0.42) | NR1I2ESR1ESR2PDE2AHSD17B2 | |
| Hydrochloric Acid SCHEMBL26113329 | 0.78 | LOXL2 (0.41) | NR1I2ESR1ESR2CYP4F2CYP4A11 | |
| SCHEMBL7670360 | 0.76 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL18290841 | 0.76 | CYP17A1 (0.47) | ESR1ESR2PDE2A | |
| SCHEMBL8236211 | 0.76 | LPL (0.42) | NR1I2ESR1ESR2CYP4F2CYP4A11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105230625-A | Antifungal composition | SYNGENTA PARTICIPATIONS AG | 2016-01-13 | — | — | CN | disclosed |