Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | GLI1 | P08151 | 1/20 | 0.42 |
| ▸ | GLI2 | P10070 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | BRD2 | P25440 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | ACACA | Q13085 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6912472 | 1.00 | PTGS1 (0.58) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL2353755 | 0.94 | PTGS1 (0.67) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL30358285 | 0.94 | PTGS1 (0.67) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL9561403 | 0.94 | PTGS1 (0.67) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL10547121 | 0.94 | PTGS1 (0.67) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL31435869 | 0.92 | PTGS1 (0.65) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL1049056 | 0.88 | PTGS1 (0.47) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL5315212 | 0.88 | PTGS1 (0.51) | PTGS1MEN1KMT2ACYP2D6UGT2B7 | |
| SCHEMBL343726 | 0.85 | AOC3 (0.57) | UGT2B7AOC3ACHEL3MBTL1 | |
| SCHEMBL43520 | 0.85 | AOC3 (0.57) | UGT2B7AOC3ACHEL3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6720439-B1 | EFFICIENT REDUCTION OF BASE SENSITIVE CARBONYL COMPOUNDS; SEPARATING RACEMIC CARBONYL COMPOUNDS; CHIRAL CATALYSTS | NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) | 2004-04-13 | — | — | US | disclosed |