Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | AGXT | P21549 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL36370 | 0.87 | TSHR (0.52) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL29806030 | 0.87 | TSHR (0.52) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL30758015 | 0.80 | IDO1 (0.45) | ALDH1A1L3MBTL1KMT2ATDP1IDO1 | |
| SCHEMBL27545548 | 0.79 | TSHR (0.44) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL1162720 | 0.79 | TSHR (0.44) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL673604 | 0.79 | TSHR (0.44) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL6213154 | 0.79 | IDO1 (0.52) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| Butane SCHEMBL9066594 | 0.79 | TSHR (0.44) | TSHRALDH1A1MAPK1L3MBTL1TDP1 | |
| SCHEMBL28921701 | 0.79 | ALDH1A1 (0.40) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 | |
| SCHEMBL698616 | 0.78 | TSHR (0.48) | TSHRALDH1A1SLC6A2SLC6A3MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0231150-B1 | ESTERIFICATION PROCESS USING A CALCIUM (HYDROXY BENZYL PHOSPHONATE) CATALYST | CIBA-GEIGY AG (CH) | 1991-11-27 | — | — | EP | disclosed |
| EP-0231150-A3 | ESTERIFICATION PROCESS USING A CALCIUM (HYDROXY BENZYL PHOSPHONATE) CATALYST | — | 1988-09-07 | — | — | EP | disclosed |
| EP-0231150-A2 | Esterification process using a calcium (hydroxy benzyl phosphonate) catalyst | CIBA-GEIGY AG (CH) | 1987-08-05 | — | — | EP | disclosed |