Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.69 |
| ▸ | CA1 | P00915 | 2/20 | 0.69 |
| ▸ | CA2 | P00918 | 2/20 | 0.69 |
| ▸ | CA7 | P43166 | 2/20 | 0.69 |
| ▸ | CA9 | Q16790 | 2/20 | 0.69 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.69 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | ESR1 | P03372 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.55 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL31125342 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31125331 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31125334 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31125308 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10581365 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17107306 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL495935 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL13422476 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31125341 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31125339 | 0.98 | CA12 (0.67) | CA12CA1CA2CA7CA9 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1187802-B1 | LIQUID CRYSTAL COMPOUNDS | ROLIC AG (CH) | 2008-01-02 | — | — | EP | disclosed |
| US-6746729-B1 | COMPONENTS OF POLYMERIZABLE LIQUID CRYSTALLINE MIXTURES IN PRODUCTION OF ORIENTATED LIQUID CRYSTALLINE POLYMER NETWORKS | ROLIC AG (CH) | 2004-06-08 | — | — | US | disclosed |
| WO-2003075882-A2 | METHOD OF DEPIGMENTING SKIN AND HAIRS | GHISALBERTI CARLO (BR) | 2003-09-18 | — | — | WO | disclosed |
| EP-1187802-A1 | LIQUID CRYSTAL COMPOUNDS | Rolic AG (CH) | 2002-03-20 | — | — | EP | disclosed |
| WO-2000063154-A1 | LIQUID CRYSTAL COMPOUNDS | ROLIC AG (CH) | 2000-10-26 | — | — | WO | disclosed |
| EP-1046631-A1 | Liquid crystalline compounds | Rolic AG (CH) | 2000-10-25 | — | — | EP | disclosed |