Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 11/20 | 0.39 |
| ▸ | CES1 | P23141 | 10/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL23270716 | 0.85 | TSHR (0.38) | CES2CES1TSHRRAB9AHPGD | |
| SCHEMBL7818599 | 0.76 | — | — | |
| SCHEMBL31487401 | 0.74 | — | — | |
| Acetophenone SCHEMBL28236150 | 0.72 | SMN1; SMN2 (0.40) | CES2CES1TSHRRAB9AHPGD | |
| SCHEMBL7116525 | 0.71 | LMNA (0.33) | CES1TSHRHPGDMAPK1MAPT | |
| SCHEMBL28539239 | 0.69 | MEN1 (0.41) | TSHRRAB9AMAPTLMNASMN1; SMN2 | |
| SCHEMBL7165670 | 0.68 | LMNA (0.38) | CES2CES1TSHRRAB9AHPGD | |
| SCHEMBL31489242 | 0.68 | NPC1 (0.39) | CES1TSHRRAB9AHPGDMAPK1 | |
| SCHEMBL3808936 | 0.68 | AKT1 (0.37) | LMNACYP11B1 | |
| SCHEMBL28232807 | 0.67 | TSHR (0.42) | TSHRRAB9AHPGDMAPK1MAPT |
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-0415990-A1 | NEW FLUORALKOXY COMPOUNDS | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1991-03-13 | — | — | EP | disclosed |
| WO-1989011479-A1 | NEW FLUORALKOXY COMPOUNDS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1989-11-30 | — | — | WO | disclosed |