Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | GBA1 | P04062 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | VDR | P11473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4574543 | 1.00 | CA12 (0.43) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL17233364 | 0.92 | CA9 (0.43) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL10345660 | 0.91 | CA12 (0.41) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL9146743 | 0.91 | CA12 (0.41) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL8143786 | 0.91 | CA12 (0.41) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL11258848 | 0.89 | CA12 (0.40) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL14959201 | 0.89 | CA12 (0.49) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL18590289 | 0.89 | CA12 (0.49) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL8984151 | 0.88 | CA12 (0.39) | CA12CA9CA2CA1STAT3 | |
| SCHEMBL3912342 | 0.87 | CA9 (0.40) | CA12CA9CA2CA1STAT3 |
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-0352054-B1 | LIQUID CRYSTAL COMPOUND | TEIKOKU CHEMICAL INDUSTRY CO., LTD. (JP) | 1993-02-10 | — | — | EP | disclosed |
| EP-0352054-A2 | Liquid crystal compound | TEIKOKU CHEMICAL INDUSTRY CO., LTD. (JP) | 1990-01-24 | — | — | EP | disclosed |