Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 5/20 | 0.45 |
| ▸ | RARB | P10826 | 6/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RARA | P10276 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
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 | 0.98 | BCHE (0.43) | BCHERARBCYP4F2CYP4A11ALOX5 | |
| SCHEMBL16807091 | 0.95 | BCHE (0.46) | BCHERARBCYP4F2CYP4A11CA2 | |
| SCHEMBL16807113 | 0.94 | CYP4A11 (0.41) | BCHERARBCYP4F2CYP4A11ALOX5 | |
| SCHEMBL16807069 | 0.94 | BCHE (0.43) | BCHERARBCYP4F2CYP4A11CA2 | |
| SCHEMBL16807128 | 0.92 | RARB (0.52) | BCHERARBACHEMEN1ALDH1A1 | |
| SCHEMBL16807106 | 0.92 | ALOX5 (0.47) | BCHERARBCYP4F2CYP4A11ALOX5 | |
| SCHEMBL16807103 | 0.92 | RARB (0.43) | BCHERARBCYP4F2CYP4A11ALOX5 | |
| SCHEMBL16807118 | 0.92 | RARB (0.49) | BCHERARBACHEMEN1ALDH1A1 | |
| SCHEMBL16807117 | 0.92 | RARB (0.52) | BCHERARBACHEMEN1ALDH1A1 | |
| SCHEMBL16807133 | 0.92 | RARB (0.52) | BCHERARBACHEMEN1ALDH1A1 |
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 |