Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.60 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.37 |
| ▸ | CHRNG | P07510 | 1/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | CHRND | Q07001 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10000525 | 0.95 | ESR1 (0.66) | ESR1ESR2MAOBMAOACHRNA1 | |
| SCHEMBL17081749 | 0.90 | ESR1 (0.50) | ESR1ESR2MAOBMAOALTA4H | |
| SCHEMBL12177591 | 0.88 | ESR2 (0.80) | ESR1ESR2MAOBMAOALTA4H | |
| SCHEMBL25919777 | 0.88 | ESR1 (0.60) | ESR1ESR2MAOBMAOACHRNA1 | |
| SCHEMBL14274358 | 0.88 | ESR1 (0.48) | ESR1ESR2MAOBMAOALTA4H | |
| SCHEMBL13508245 | 0.88 | ESR1 (0.48) | ESR1ESR2MAOBMAOALTA4H | |
| SCHEMBL13382522 | 0.86 | ESR1 (0.55) | ESR1ESR2MAOBMAOAKMT2A | |
| SCHEMBL10175309 | 0.86 | ESR1 (0.55) | ESR1ESR2MAOBMAOACHRNA1 | |
| SCHEMBL14064751 | 0.86 | ESR1 (0.49) | ESR1ESR2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL20169141 | 0.86 | ESR1 (0.46) | ESR1ESR2LTA4HHTTGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-20230235115-A1 | ESTER COMPOUND AND RESIN COMPOSITION | AJINOMOTO CO., INC. (JP) | 2023-07-27 | — | — | US | disclosed |