Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | FBP1 | P09467 | 4/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 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 | |
|---|---|---|---|---|
| Water SCHEMBL29120229 | 0.89 | EGFR (0.52) | ALDH1A1CYP2A6KMT2AKDM4ELMNA | |
| SCHEMBL7047 | 0.89 | EGFR (0.52) | ALDH1A1CYP2A6KMT2AKDM4ELMNA | |
| Hydrochloric Acid SCHEMBL28598774 | 0.87 | EGFR (0.50) | ALDH1A1CYP2A6KMT2AKDM4ELMNA | |
| Water SCHEMBL28202451 | 0.84 | CYP2A6 (0.94) | ALDH1A1CYP2A6KDM4EEGFRFBP1 | |
| SCHEMBL14567202 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CYP2A6KMT2AKDM4ELMNA | |
| SCHEMBL4453443 | 0.83 | CYP2A6 (0.73) | ALDH1A1CYP2A6KDM4ETYR | |
| SCHEMBL10923571 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CYP2A6KMT2AKDM4ELMNA | |
| SCHEMBL3189884 | 0.83 | HDAC2 (0.53) | ALDH1A1KDM4ELMNAGAAEGFR | |
| SCHEMBL10923574 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CYP2A6KMT2AKDM4ELMNA | |
| SCHEMBL3006203 | 0.83 | EGFR (0.47) | ALDH1A1CYP2A6KMT2AKDM4ELMNA |
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-6028182-A | Methylphosphonic acid esters, processes for their preparation, and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 2000-02-22 | — | — | US | disclosed |