Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.38 |
| ▸ | GLRB | P48167 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2905207 | 0.79 | TDP1 (0.36) | ALDH1A1GLRA3GLRBLMNAALOX15 | |
| SCHEMBL25469331 | 0.77 | CYP3A4 (0.41) | — | |
| SCHEMBL6264063 | 0.77 | CYP3A4 (0.41) | — | |
| SCHEMBL14032468 | 0.77 | CYP3A4 (0.41) | — | |
| SCHEMBL10769689 | 0.76 | HMGCR (0.54) | ALDH1A1GLRA3GLRBLMNAALOX15 | |
| SCHEMBL1278385 | 0.76 | HMGCR (0.54) | ALDH1A1GLRA3GLRBLMNAALOX15 | |
| SCHEMBL23964694 | 0.75 | OPRM1 (0.43) | CYP2C9KDM4EMAPTFFAR4RECQL | |
| SCHEMBL17621681 | 0.75 | ALOX15 (0.44) | ALDH1A1GLRA3GLRBELANELMNA | |
| Methane SCHEMBL5017099 | 0.75 | HMGCR (0.52) | ALDH1A1GLRA3GLRBLMNAALOX15 | |
| Methane SCHEMBL8586981 | 0.75 | HMGCR (0.52) | ALDH1A1GLRA3GLRBLMNAALOX15 |
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-0590360-B1 | Process for the preparation of aryl-substituted propionic acid esters | MONTELL NORTH AMERICA INC (US) | 1996-12-27 | — | — | EP | disclosed |
| EP-0590360-A2 | Process for the preparation of aryl-substituted propionic acid esters | MONTELL NORTH AMERICA INC. (US) | 1994-04-06 | — | — | EP | disclosed |
| US-5264612-A | Process for the preparation of aryl-substituted propionic acid esters | HIMONT INCORPORATED (US) | 1993-11-23 | — | — | US | disclosed |