Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 10/20 | 0.69 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.69 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.69 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.69 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | CNR2 | P34972 | 2/20 | 0.55 |
| ▸ | CNR1 | P21554 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7597450 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL7590202 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL28569758 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL7591463 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL28571264 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL7595555 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL28571318 | 1.00 | ESR1 (0.69) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL7590980 | 0.98 | ESR1 (0.66) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL7592525 | 0.93 | ESR1 (0.73) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL9355632 | 0.93 | ESR1 (0.77) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 |
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-109956869-B | Preparation method of room-temperature phosphorescent benzoate compound | 北京大学 | 2021-05-28 | — | — | CN | disclosed |