Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 7/20 | 0.52 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.37 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.37 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9314982 | 0.95 | ESR2 (0.47) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9314991 | 0.95 | ESR2 (0.47) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9314978 | 0.95 | ESR2 (0.47) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9762745 | 0.88 | ESR2 (0.41) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9762748 | 0.88 | ESR2 (0.41) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9762751 | 0.88 | ESR2 (0.41) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9313379 | 0.83 | ESR2 (0.49) | ESR2SPHK1CACNA1GCACNA1HCACNA1I | |
| SCHEMBL9313373 | 0.83 | ESR2 (0.49) | ESR2SPHK1CACNA1GCACNA1HCACNA1I | |
| SCHEMBL6663436 | 0.82 | ESR2 (0.49) | ESR2SPHK1ESR1CYP2C9CYP3A4 | |
| SCHEMBL9315767 | 0.80 | CYP2C9 (0.39) | ESR2SPHK1ESR1CYP2C9CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-9617473-B2 | Switch element comprising a liquid-crystalline medium | MERCK PATENT GMBH (DE) | 2017-04-11 | — | — | US | disclosed |
| US-20130155338-A1 | SWITCH ELEMENT COMPRISING A LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2013-06-20 | — | — | US | disclosed |