Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7903784 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRHSD17B10KMT2AHPGD | |
| SCHEMBL8834471 | 0.79 | RECQL (0.37) | ALDH1A1TSHRHSD17B10KMT2AHTT | |
| SCHEMBL8833614 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TSHRHSD17B10KMT2AHTT | |
| SCHEMBL8833937 | 0.76 | FFAR4 (0.36) | ALDH1A1TSHRHSD17B10RAB9AFFAR4 | |
| SCHEMBL8834655 | 0.75 | PPARD (0.38) | RAB9AFFAR4FFAR1VCPMMP12 | |
| SCHEMBL7911982 | 0.74 | KMT2A (0.41) | ALDH1A1KMT2AHPGDHTTSMN1; SMN2 | |
| SCHEMBL7911988 | 0.74 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10KMT2AHTT | |
| SCHEMBL7914029 | 0.72 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10RAB9AVCP | |
| SCHEMBL7911794 | 0.72 | ATM (0.38) | ALDH1A1KMT2AHPGDHTTMEN1 | |
| SCHEMBL7917456 | 0.72 | ALDH1A1 (0.47) | ALDH1A1TSHRHSD17B10KMT2AHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0640578-B2 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | CHISSO CORP (JP) | 2001-06-27 | — | — | EP | disclosed |
| EP-0640578-B1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | CHISSO CORP (JP) | 1997-11-05 | — | — | EP | disclosed |
| EP-0640578-A1 | Novel liquid crystalline compound having a 1,1,2,3,3,3,-hexafluoropropyl group and liquid crystal composition | Chisso Corporation (JP) | 1995-03-01 | — | — | EP | disclosed |