Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7236361 | 1.00 | TSHR (0.35) | TSHRMEN1KMT2AALDH1A1AKR1C3 | |
| SCHEMBL4675007 | 0.79 | AKR1C3 (0.44) | MEN1KMT2AALDH1A1AKR1C3KDM4E | |
| SCHEMBL4674580 | 0.75 | ALDH1A1 (0.39) | MEN1KMT2AALDH1A1AKR1C3CNR1 | |
| SCHEMBL4673009 | 0.73 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1AKR1C3KDM4E | |
| SCHEMBL4672360 | 0.69 | RAPGEF4 (0.47) | ALDH1A1AKR1C3KDM4EALDH3A1AKR1C2 | |
| SCHEMBL4677989 | 0.69 | ALDH1A1 (0.63) | MEN1KMT2AALDH1A1AKR1C3KDM4E | |
| SCHEMBL4677987 | 0.69 | ALDH1A1 (0.63) | MEN1KMT2AALDH1A1AKR1C3KDM4E | |
| SCHEMBL4672356 | 0.69 | RAPGEF4 (0.47) | ALDH1A1AKR1C3KDM4EALDH3A1AKR1C2 | |
| SCHEMBL4672259 | 0.68 | ALDH1A1 (0.37) | MEN1KMT2AALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL4672257 | 0.68 | ALDH1A1 (0.37) | MEN1KMT2AALDH1A1AKR1C3AKR1C2 |
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-6645956-B1 | 1-(5-(4-fluorobenzyl)furan-2-yl)-3-hydroxy-3-(1H-1,2,4-triazol-3 -yl)-propenone; viricides; AIDS treatment | SHIONOGI & CO., LTD. (JP) | 2003-11-11 | — | — | US | disclosed |