Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11068778 | 0.75 | ALDH1A1 (0.45) | ALDH1A1NPSR1MAPTHPGDHTT | |
| Trifluoroacetic Acid SCHEMBL8798382 | 0.73 | ALDH1A1 (0.54) | ALDH1A1NPSR1MAPTHPGDHTT | |
| SCHEMBL8798390 | 0.73 | ALDH1A1 (0.54) | ALDH1A1NPSR1MAPTHPGDHTT | |
| SCHEMBL18152842 | 0.72 | CFTR (0.47) | ALDH1A1NPSR1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL9700195 | 0.71 | CFTR (0.44) | ALDH1A1NPSR1MAPTHPGDHTT | |
| SCHEMBL10992447 | 0.71 | LMNA (0.51) | ALDH1A1NPSR1MAPTHPGDHTT | |
| SCHEMBL10997238 | 0.70 | ALDH1A1 (0.52) | ALDH1A1NPSR1MAPTHPGDHTT | |
| SCHEMBL10992481 | 0.69 | HTT (0.52) | ALDH1A1NPSR1MAPTHPGDHTT | |
| SCHEMBL8104170 | 0.69 | FAAH (0.70) | GAAMEN1KMT2AFAAH | |
| SCHEMBL8104149 | 0.69 | FAAH (0.70) | GAAMEN1KMT2AFAAH |
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 |
|---|---|---|---|---|---|---|---|
| EP-0045081-B1 | TRISUBSTITUTED IMIDAZOLE DERIVATIVES, PROCESSES FOR PREPARING THEM, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE | CIBA-GEIGY AG (CH) | 1986-01-08 | — | — | EP | disclosed |
| EP-0045081-A2 | Trisubstituted imidazole derivatives, processes for preparing them, pharmaceutical compositions containing them, and their use | CIBA-GEIGY AG (CH) | 1982-02-03 | — | — | EP | disclosed |