Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 3/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | ACP3 | P15309 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24554823 | 0.92 | MAPT (0.50) | NQO2PTGS1PTGS2MAPTALDH1A1 | |
| SCHEMBL12197987 | 0.79 | NQO2 (0.56) | NQO2PTGS1PTGS2CES2CES1 | |
| SCHEMBL18522529 | 0.79 | NQO2 (0.56) | NQO2PTGS1PTGS2CES2CES1 | |
| SCHEMBL29629244 | 0.78 | ALOX5 (0.41) | PTGS1PTGS2CES2CES1MAPT | |
| SCHEMBL24554814 | 0.77 | NQO2 (0.50) | NQO2PTGS1PTGS2CES2CES1 | |
| SCHEMBL5078619 | 0.74 | NQO2 (0.60) | NQO2PTGS1PTGS2CES2CES1 | |
| SCHEMBL5080817 | 0.74 | NQO2 (0.60) | NQO2PTGS1PTGS2CES2CES1 | |
| SCHEMBL5078621 | 0.74 | NQO2 (0.60) | NQO2PTGS1PTGS2CES2CES1 | |
| SCHEMBL29016298 | 0.73 | LMNA (0.41) | CES2CES1ALDH1A1KDM4EHPGD | |
| SCHEMBL11526523 | 0.73 | LMNA (0.41) | CES2CES1ALDH1A1KDM4EHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114426564-B | Chiral ferrocene phosphine-1, 2-diphenyl ethylenediamine ligand and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2023-09-08 | — | — | CN | disclosed |
| CN-114426564-A | Chiral ferrocenyl phosphine-1, 2-diphenyl ethylene diamine ligand and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2022-05-03 | — | — | CN | disclosed |