Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7235135 | 1.00 | TSHR (0.36) | TSHRSMN1; SMN2KDM4EHPGDALDH1A1 | |
| SCHEMBL4671836 | 0.81 | MAPT (0.46) | KDM4EHPGDALDH1A1CYP3A4MAPT | |
| SCHEMBL4671840 | 0.81 | MAPT (0.46) | KDM4EHPGDALDH1A1CYP3A4MAPT | |
| SCHEMBL4673354 | 0.71 | ALDH1A1 (0.40) | TSHRSMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL4673350 | 0.71 | ALDH1A1 (0.40) | TSHRSMN1; SMN2KDM4EALDH1A1MAPT | |
| SCHEMBL4672643 | 0.68 | MMP1 (0.38) | MAPTHSD11B1 | |
| SCHEMBL4672646 | 0.68 | MMP1 (0.38) | MAPTHSD11B1 | |
| SCHEMBL11815654 | 0.66 | TSHR (0.55) | TSHRSMN1; SMN2KDM4EHPGDALDH1A1 | |
| SCHEMBL4677260 | 0.64 | CYP2C9 (0.41) | TSHRCYP2C9L3MBTL1 | |
| SCHEMBL4677257 | 0.64 | CYP2C9 (0.41) | TSHRCYP2C9L3MBTL1 |
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 |