Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 6/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9970222 | 0.83 | PTGS2 (0.36) | PTGS2ALDH1A1NPSR1HSD17B10HPGD | |
| SCHEMBL20067758 | 0.81 | ALDH1A1 (0.41) | PTGS2ALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL22561016 | 0.81 | CA12 (0.52) | APPPTGS2ABL1ABCB1BCR | |
| SCHEMBL1105472 | 0.79 | APP (0.76) | APPALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL9970218 | 0.79 | APP (0.42) | APPALDH1A1HPGDCYP1A2CYP2E1 | |
| SCHEMBL172439 | 0.78 | ACHE (0.60) | ABL1ABCB1BCRNPSR1HPGD | |
| SCHEMBL17775109 | 0.76 | ABL1 (0.43) | APPPTGS2ABL1ABCB1BCR | |
| SCHEMBL27027366 | 0.76 | CHRM2 (0.37) | APPPTGS2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17775112 | 0.75 | ESR2 (0.44) | APPPTGS2ALDH1A1ABL1ABCB1 | |
| SCHEMBL6712384 | 0.74 | CYP2C19 (0.46) | APPPTGS2ABL1ABCB1BCR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2239310-B1 | Liquid crystal medium and liquid crystal display | MERCK PATENT GMBH (DE) | 2012-06-27 | — | — | EP | disclosed |
| US-8202584-B2 | Liquid-crystalline medium and liquid-crystal display | MERCK PATENT GMBH (DE) | 2012-06-19 | — | — | US | disclosed |
| EP-2239310-A1 | Liquid crystal medium and liquid crystal display | Merck Patent GmbH (DE) | 2010-10-13 | — | — | EP | disclosed |
| US-20100252777-A1 | LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2010-10-07 | — | — | US | disclosed |