Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.54 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.41 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.41 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.40 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.40 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.40 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.40 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.40 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17249597 | 0.89 | MAP2K4 (0.46) | KIF11BACE1PDK2MAP2K4PRKAB2 | |
| SCHEMBL15725317 | 0.89 | BACE1 (0.46) | KIF11BACE1PTGES2PDE3BPDE3A | |
| SCHEMBL19820862 | 0.88 | PDE3B (0.46) | KIF11BACE1PTGES2PDE3BPDE3A | |
| SCHEMBL170435 | 0.87 | PDE3B (0.49) | PTGES2PDK2PDE3BPDE3ARPS6KA3 | |
| SCHEMBL15725310 | 0.87 | BACE1 (0.45) | KIF11BACE1PTGES2PDE3BPDE3A | |
| SCHEMBL14175160 | 0.86 | PDE3B (0.45) | KIF11BACE1PTGES2PDE3BPDE3A | |
| SCHEMBL14175159 | 0.86 | PDE3B (0.45) | KIF11BACE1PTGES2PDE3BPDE3A | |
| SCHEMBL18354770 | 0.86 | PTGES2 (0.42) | KIF11BACE1PTGES2PDE3BPDE3A | |
| SCHEMBL4567629 | 0.85 | PDE3B (0.48) | PDK2PDE3BPDE3ARPS6KA3PTGS2 | |
| SCHEMBL4567630 | 0.85 | PDE3B (0.50) | PTGES2PDK2PDE3BPDE3ARPS6KA3 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |