Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 7/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 6/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 2/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.38 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 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 | |
|---|---|---|---|---|
| SCHEMBL16807085 | 0.92 | BACE1 (0.45) | FFAR1FFAR4BACE1CYP4F2CYP4A11 | |
| SCHEMBL16807131 | 0.91 | RARB (0.42) | FFAR1FFAR4BACE1CYP4A11RARB | |
| SCHEMBL16807101 | 0.91 | BACE1 (0.44) | FFAR1FFAR4BACE1CYP4F2CYP4A11 | |
| SCHEMBL15725316 | 0.90 | BACE1 (0.46) | FFAR1FFAR4BACE1CYP4F2CYP4A11 | |
| SCHEMBL16807140 | 0.90 | TSHR (0.40) | CYP4F2CYP4A11RARBTSHRMCL1 | |
| SCHEMBL16807134 | 0.90 | RARB (0.44) | FFAR1FFAR4BACE1CYP4F2CYP4A11 | |
| SCHEMBL16807136 | 0.89 | MCL1 (0.48) | CYP4F2CYP4A11RARBTSHRMCL1 | |
| SCHEMBL16807126 | 0.88 | RARB (0.46) | FFAR1FFAR4CYP4F2CYP4A11RARB | |
| SCHEMBL16807130 | 0.87 | MAP2K4 (0.40) | FFAR1FFAR4BACE1MCL1HSD17B1 | |
| SCHEMBL16807147 | 0.86 | RARB (0.50) | RARB |
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 |