Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | FBP1 | P09467 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28975332 | 0.85 | CES2 (0.50) | AKR1C3MEN1KMT2AFBP1CES2 | |
| SCHEMBL31352034 | 0.82 | AKR1C3 (0.64) | AKR1C3MEN1KMT2AFBP1CES2 | |
| SCHEMBL12396535 | 0.82 | AKR1C3 (0.64) | AKR1C3MEN1KMT2AFBP1CES2 | |
| SCHEMBL8038875 | 0.82 | MEN1 (0.63) | AKR1C3MEN1KMT2AFBP1CES2 | |
| SCHEMBL30752455 | 0.78 | RECQL (0.55) | AKR1C3MEN1KMT2AFBP1CES2 | |
| SCHEMBL7659594 | 0.78 | MCL1 (0.46) | AKR1C3MEN1KMT2AFBP1CES2 | |
| SCHEMBL10932008 | 0.78 | AKR1C3 (0.63) | AKR1C3MEN1KMT2AFBP1RECQL | |
| SCHEMBL1804115 | 0.77 | AKR1C3 (0.61) | AKR1C3MEN1KMT2AFBP1RECQL | |
| SCHEMBL1804114 | 0.77 | AKR1C3 (0.61) | AKR1C3MEN1KMT2AFBP1RECQL | |
| SCHEMBL1481710 | 0.77 | AKR1C3 (0.61) | AKR1C3MEN1KMT2AFBP1RECQL |
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-118955267-A | Alpha-bromo-alpha, beta-unsaturated ketone compound and application thereof in preparation of plant parasitic nematode prevention and control medicines | 陕西省生物农业研究所 | 2024-11-15 | — | — | CN | disclosed |
| CN-105061504-A | Preparation method of P-alkynyl phosphate compound | UNIV HUNAN | 2015-11-18 | — | — | CN | disclosed |