Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.56 |
| ▸ | CES2 | O00748 | 2/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | RXRA | P19793 | 2/20 | 0.45 |
| ▸ | RXRB | P28702 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | FABP1 | P07148 | 1/20 | 0.40 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 3/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
| ▸ | LDHB | P07195 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9056792 | 0.89 | CES2 (0.66) | LMNACES2CES1KDM4EALDH1A1 | |
| SCHEMBL11626407 | 0.80 | CES2 (0.69) | LMNACES2CES1KDM4EALDH1A1 | |
| Benzoin SCHEMBL19468545 | 0.80 | CES2 (0.81) | LMNACES2CES1KDM4EALDH1A1 | |
| Benzoin SCHEMBL27526563 | 0.79 | CES2 (0.88) | LMNACES2CES1KDM4EALDH1A1 | |
| SCHEMBL11587933 | 0.79 | CES2 (0.67) | LMNACES2CES1KDM4EALDH1A1 | |
| SCHEMBL6832799 | 0.78 | LMNA (0.77) | LMNACES2CES1KDM4EALDH1A1 | |
| SCHEMBL7247750 | 0.78 | RXRA (0.66) | RXRARXRBPOLBMAPTCTDSP1 | |
| SCHEMBL18354583 | 0.76 | MAPT (0.59) | LMNAALDH1A1RXRARXRBSMN1; SMN2 | |
| SCHEMBL66647 | 0.76 | LMNA (0.74) | LMNACES2CES1KDM4EALDH1A1 | |
| Benzoin SCHEMBL28292944 | 0.76 | CES2 (0.81) | LMNACES2CES1KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022116242-A1 | SIMPLE SYNTHESIS METHOD FOR META-SUBSTITUTED PHENOL ETHER AND PHENOL | 广东石油化工学院 | 2022-06-09 | — | — | WO | disclosed |