Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 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 | |
|---|---|---|---|---|
| SCHEMBL9823677 | 0.87 | LMNA (0.43) | ALDH1A1LMNAMAPTHTTMEN1 | |
| SCHEMBL9823586 | 0.82 | SMN1; SMN2 (0.40) | ALDH1A1LMNAMAPTHSP90AA1PKM | |
| SCHEMBL9823846 | 0.82 | CCR5 (0.45) | MAPTHTR2AHTR2C | |
| SCHEMBL9823802 | 0.69 | KMT2A (0.44) | ALDH1A1MAPTSMN1; SMN2HTTCYP19A1 | |
| SCHEMBL16953749 | 0.67 | RORC (0.44) | ALDH1A1LMNAMAPTSMN1; SMN2HMOX1 | |
| SCHEMBL3045049 | 0.66 | KMT2A (0.52) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL16962913 | 0.65 | CSNK2A1 (0.41) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL9823697 | 0.65 | ADRB2 (0.48) | MAPTSMN1; SMN2HMOX1S1PR1ADRB2 | |
| SCHEMBL17040592 | 0.64 | TSHR (0.53) | ALDH1A1HPGDMAPK1SMN1; SMN2ADRB1 | |
| SCHEMBL16146937 | 0.63 | IRAK4 (0.60) | ALDH1A1MAPTHMOX1IRAK4MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0227100-B1 | N-VINYLIMIDAZOLES AND -TRIAZOLES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1991-04-03 | — | — | EP | claimed |