Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4A11 | Q02928 | 4/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16807104 | 0.95 | BCHE (0.43) | CYP4A11CYP4F2ALOX5BACE1RARB | |
| SCHEMBL16807081 | 0.95 | CYP4A11 (0.42) | CYP4A11CYP4F2BACE1RARBBCHE | |
| SCHEMBL16807108 | 0.94 | BCHE (0.45) | CYP4A11CYP4F2ALOX5BACE1RARB | |
| SCHEMBL16807094 | 0.91 | BACE1 (0.42) | CYP4A11CYP4F2ALOX5BACE1RARB | |
| SCHEMBL16807107 | 0.91 | ALOX5 (0.49) | CYP4A11CYP4F2ALOX5BACE1RARB | |
| SCHEMBL16807116 | 0.91 | RARB (0.45) | CYP4A11ALOX5RARBCA2 | |
| SCHEMBL16807069 | 0.91 | BCHE (0.43) | CYP4A11CYP4F2BACE1RARBBCHE | |
| SCHEMBL16807143 | 0.91 | CYP4A11 (0.44) | CYP4A11CYP4F2RARBCA2PRKAB2 | |
| SCHEMBL16807111 | 0.90 | ALOX5 (0.43) | CYP4A11CYP4F2ALOX5BACE1RORC | |
| SCHEMBL16807121 | 0.90 | RARB (0.50) | ALOX5RARBEGFR |
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-20150166890-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-06-18 | — | — | US | disclosed |
| US-20150166890-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-06-18 | — | — | US | disclosed |