Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1888270 | 0.81 | GAA (0.38) | ALDH1A1GAAEPHX2SMN1; SMN2TDP1 | |
| SCHEMBL4591586 | 0.74 | CA12 (0.32) | ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL607551 | 0.73 | — | — | |
| SCHEMBL10798431 | 0.73 | — | — | |
| SCHEMBL10529046 | 0.72 | KDM1A (0.36) | — | |
| Hydrochloric Acid SCHEMBL5031179 | 0.72 | — | — | |
| SCHEMBL7758481 | 0.71 | TSHR (0.39) | ALDH1A1GAATSHRCYP3A4SMN1; SMN2 | |
| SCHEMBL29651469 | 0.70 | CA4 (0.34) | — | |
| SCHEMBL1276353 | 0.70 | TSHR (0.47) | ALDH1A1GAATSHRNPSR1CYP3A4 | |
| SCHEMBL19371109 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1931619-B1 | METHANESULPHONIC ACID SALT OF DIHYDROPHENYLGLYCINE METHYL ESTER OR OF PHENYLGLYCINE METHYL ESTER | DSM SINOCHEM PHARM NL BV (NL) | 2015-06-24 | — | — | EP | disclosed |
| CN-104628586-A | PROCESS FOR ESTERIFICATION OF AN ORGANIC ACID | DSM IP ASSETS BV | 2015-05-20 | — | — | CN | disclosed |
| US-20080249329-A1 | Process For Esterification Of An Organic Acid | DSM IP ASSETS B.V. (NL) | 2008-10-09 | — | — | US | disclosed |
| EP-1931619-A2 | PROCESS FOR ESTERIFICATION OF AN ORGANIC ACID | DSMIP Assets B.V. (NL) | 2008-06-18 | — | — | EP | disclosed |
| WO-2007039522-A2 | PROCESS FOR ESTERIFICATION OF AN ORGANIC ACID | DSM IP ASSETS B.V. (NL) | 2007-04-12 | — | — | WO | disclosed |