Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11025357 | 0.85 | TSHR (0.56) | ALDH1A1L3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL8964976 | 0.85 | TSHR (0.56) | ALDH1A1L3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL6676165 | 0.83 | ALDH1A1 (0.56) | ALDH1A1MAPTHTTNPSR1OPRM1 | |
| SCHEMBL8965070 | 0.81 | CES1 (0.49) | ALDH1A1MAPTNPSR1OPRK1MEN1 | |
| SCHEMBL8964825 | 0.80 | KLK7 (0.59) | ALDH1A1L3MBTL1SMN1; SMN2TDP1TSHR | |
| SCHEMBL7262891 | 0.78 | CES2 (0.49) | ALDH1A1MAPTNPSR1CYP2C19OPRK1 | |
| SCHEMBL8964999 | 0.75 | LMNA (0.45) | ALDH1A1MAPTHTTCYP1A2CYP2C19 | |
| SCHEMBL27836917 | 0.72 | TSHR (0.40) | ALDH1A1MEN1KMT2AGAASMN1; SMN2 | |
| SCHEMBL10780199 | 0.72 | TSHR (0.57) | ALDH1A1L3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL1200602 | 0.72 | TSHR (0.45) | ALDH1A1L3MBTL1SMN1; SMN2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5493047-A | REACTING OPTICALLY ACTIVE CYANOHYDRIN WITH CARBOXYLIC ACID IN PRESENCE OF DIALKYL AZODICARBOXYLATE AND TRIPHENYLPHOSPHINE TO FORM ESTER OF OPPOSITE CONFIGURATION | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1996-02-20 | — | — | US | disclosed |
| EP-0601237-A1 | Method of preparing optically active cyanohydrin derivatives | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1994-06-15 | — | — | EP | disclosed |
| EP-0601632-A1 | Method of preparing optically active cyanohydrin derivatives | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1994-06-15 | — | — | EP | disclosed |