Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.48 |
| ▸ | RAB9A | P51151 | 7/20 | 0.48 |
| ▸ | LMNA | P02545 | 6/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ATP4A | P20648 | 1/20 | 0.41 |
| ▸ | ATP4B | P51164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4599530 | 0.80 | ALDH1A1 (0.38) | CYP19A1NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL6027103 | 0.77 | CYP19A1 (0.47) | CYP19A1NPC1RAB9ATP53MEN1 | |
| SCHEMBL14996228 | 0.77 | ATP4A (0.53) | CYP19A1NPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL13201562 | 0.76 | ATP4A (0.53) | CYP19A1LMNAATP4AATP4BKDM4E | |
| SCHEMBL4600552 | 0.75 | CYP19A1 (0.42) | CYP19A1NPC1LMNAHTTMEN1 | |
| SCHEMBL14189706 | 0.74 | ATP4A (0.52) | CYP19A1LMNAHTTMEN1KMT2A | |
| SCHEMBL763549 | 0.72 | QPCT (0.51) | CYP19A1RAB9ALMNASMN1; SMN2TP53 | |
| SCHEMBL13617692 | 0.71 | ATP4A (0.50) | CYP19A1MEN1KMT2AATP4AATP4B | |
| SCHEMBL765017 | 0.71 | QPCT (0.56) | CYP19A1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL22397927 | 0.71 | MEN1 (0.55) | CYP19A1NPC1RAB9ALMNASMN1; SMN2 |
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-1725549-A1 | PENTAFLUOROSULFANYL COMPOUNDS, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2006-11-29 | — | — | EP | disclosed |
| WO-2005095388-A1 | PENTAFLUOROSULFANYL COMPOUNDS, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-10-13 | — | — | WO | disclosed |