Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | CASP9 | P55211 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | NTSR1 | P30989 | 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 | |
|---|---|---|---|---|
| SCHEMBL2009931 | 0.89 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1ESR1ABCB1CASP3 | |
| Bromide SCHEMBL5787146 | 0.88 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1ESR1ABCB1CASP3 | |
| SCHEMBL7328604 | 0.88 | ESR1 (0.52) | ALDH1A1L3MBTL1ESR1ABCB1CASP3 | |
| SCHEMBL6812575 | 0.86 | NPSR1 (0.49) | ALDH1A1MAPK1L3MBTL1NPSR1LMNA | |
| SCHEMBL6809954 | 0.86 | GAA (0.50) | ALDH1A1L3MBTL1ESR1ABCB1CASP3 | |
| SCHEMBL6813482 | 0.86 | L3MBTL1 (0.52) | ALDH1A1L3MBTL1ESR1ABCB1CASP3 | |
| SCHEMBL2012596 | 0.85 | ALDH1A1 (0.51) | ALDH1A1MAPK1L3MBTL1HPGDNPSR1 | |
| SCHEMBL7462216 | 0.85 | ALDH1A1 (0.60) | ALDH1A1MAPK1L3MBTL1SMN1; SMN2HPGD | |
| SCHEMBL2009817 | 0.82 | ESR1 (0.42) | ALDH1A1L3MBTL1ESR1ABCB1CASP3 | |
| SCHEMBL2009646 | 0.81 | NPC1 (0.51) | ALDH1A1MAPK1L3MBTL1SMN1; SMN2HPGD |
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-1095932-B1 | PHENOXYACETIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME | KISSEI PHARMACEUTICAL (JP) | 2004-05-19 | — | — | EP | disclosed |
| US-6538152-B1 | Obesity, hyperglycemia, urinary incontinence, intestinal or biliary calculi hypermotility, pollakiuria and depression treatment | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2003-03-25 | — | — | US | disclosed |
| EP-1095932-A1 | PHENOXYACETIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME | Kissei Pharmaceutical Co., Ltd. (JP) | 2001-05-02 | — | — | EP | disclosed |