Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9717863 | 0.83 | ALDH1A1 (0.52) | ALDH1A1GAASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL20239680 | 0.83 | ALDH1A1 (0.52) | ALDH1A1GAASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL11749020 | 0.80 | ALDH1A1 (0.57) | ALDH1A1GAASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL9717857 | 0.78 | ALDH1A1 (0.47) | ALDH1A1GAASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL891457 | 0.78 | ALDH1A1 (0.55) | ALDH1A1GAASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL10485701 | 0.76 | ALDH1A1 (0.53) | ALDH1A1GAASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL872796 | 0.74 | — | — | |
| SCHEMBL9463645 | 0.74 | — | — | |
| SCHEMBL4460549 | 0.74 | — | — | |
| SCHEMBL288032 | 0.74 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0068732-B1 | HERBICIDALLY ACTIVE MONOESTERS AND DIESTERS OF N-ALKYL SUBSTITUTED AMINO METHYL PHOSPHONIC ACID AND PROCESS FOR PREPARING SAME | MONSANTO COMPANY (US) | 1985-08-28 | — | — | EP | disclosed |
| US-4483705-A | Alkylphosphonate diesters and monoesters of N-phosphonomethylglycinate as herbicides | MONSANTO CO. (US) | 1984-11-20 | — | — | US | disclosed |
| US-4442044-A | FROM A PHOSPHITE, A SATURATED TRIAZINE TRIESTER AND WATER | MONSANTO COMPANY (US) | 1984-04-10 | — | — | US | disclosed |
| EP-0068732-A1 | Herbicidally active monoesters and diesters of n-alkyl substituted amino methyl phosphonic acid and process for preparing same | MONSANTO COMPANY (US) | 1983-01-05 | — | — | EP | disclosed |