Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9044253 | 0.81 | ALDH1A1 (0.38) | ALDH1A1GAAL3MBTL1KDM4EGLA | |
| SCHEMBL10663894 | 0.78 | CA12 (0.48) | CA12CA1CA9ALDH1A1STAT3 | |
| SCHEMBL9042937 | 0.77 | ALDH1A1 (0.39) | ALDH1A1GAAL3MBTL1KDM4EGLA | |
| SCHEMBL9042766 | 0.76 | PTPRC (0.47) | L3MBTL1HTTPKMLMNAMAPT | |
| SCHEMBL9042817 | 0.74 | L3MBTL1 (0.40) | ALDH1A1L3MBTL1HTTPKMLMNA | |
| SCHEMBL9042223 | 0.73 | FFAR1 (0.39) | ALDH1A1L3MBTL1KMT2ALMNACYP2D6 | |
| SCHEMBL9042022 | 0.72 | PTPRC (0.37) | ALDH1A1GAAL3MBTL1HTTKDM4E | |
| SCHEMBL9044386 | 0.71 | L3MBTL1 (0.39) | ALDH1A1GAAL3MBTL1HTTPKM | |
| SCHEMBL9043071 | 0.71 | PPARA (0.34) | ALDH1A1GAAL3MBTL1KDM4EPKM | |
| SCHEMBL9044383 | 0.71 | L3MBTL1 (0.39) | ALDH1A1GAAL3MBTL1HTTPKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5344843-A | Carnitine acryltransferase enzyme inhibitors as antiischemic agents and for cardiovascular disorders | HOFFMAN-LA ROCHE INC. (US) | 1994-09-06 | — | — | US | disclosed |
| EP-0512352-A2 | Substituted carboxylic acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1992-11-11 | — | — | EP | disclosed |