Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.59 |
| ▸ | ABL1 | P00519 | 3/20 | 0.56 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.56 |
| ▸ | BCR | P11274 | 3/20 | 0.56 |
| ▸ | KIF11 | P52732 | 2/20 | 0.55 |
| ▸ | ANPEP | P15144 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.45 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5099663 | 1.00 | ESR1 (0.62) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL17108385 | 0.87 | ANPEP (0.42) | ESR1ESR2KIF11ANPEPHSD17B1 | |
| SCHEMBL13104729 | 0.85 | ESR1 (0.67) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL1254675 | 0.85 | ESR1 (0.52) | ESR1ESR2KIF11MEN1KMT2A | |
| SCHEMBL18388215 | 0.85 | ESR1 (0.52) | ESR1ESR2KIF11MEN1KMT2A | |
| Phenol SCHEMBL27463236 | 0.84 | MMP3 (0.52) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL20821889 | 0.83 | ESR1 (0.55) | ESR1ESR2KIF11MEN1KMT2A | |
| SCHEMBL13628948 | 0.83 | ESR2 (0.52) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL13105050 | 0.81 | ESR1 (0.56) | ESR1ESR2ABL1ABCB1BCR | |
| SCHEMBL1630267 | 0.81 | ESR1 (0.79) | ESR1ESR2ABL1ABCB1BCR |
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-2729550-B1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-02-21 | — | — | EP | disclosed |
| US-9234136-B2 | Liquid-crystalline medium | MERCK PATENT GMBH (DE) | 2016-01-12 | — | — | US | disclosed |
| US-9234136-B2 | Liquid-crystalline medium | MERCK PATENT GMBH (DE) | 2016-01-12 | — | — | US | disclosed |
| US-20140138581-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2014-05-22 | — | — | US | disclosed |
| US-20140138581-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2014-05-22 | — | — | US | disclosed |
| WO-2012074236-A2 | BIMESOGENIC COMPOUND EXHIBITING FAST RESPONSE CHARACTERISTICS BY MEANS OF CONTROLLING THE DIELECTRIC ANISOTROPY OF BOTH MESOGENIC GROUPS | 주식회사 동진쎄미켐 (KR) | 2012-06-07 | — | — | WO | disclosed |