Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R2 | Q9NPC1 | 8/20 | 0.42 |
| ▸ | BRS3 | P32247 | 4/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 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 | |
|---|---|---|---|---|
| SCHEMBL4826396 | 1.00 | LTB4R2 (0.42) | LTB4R2BRS3AGTR1MCL1PPARG | |
| SCHEMBL4826752 | 0.92 | LTB4R2 (0.43) | LTB4R2BRS3MCL1PPARG | |
| SCHEMBL9447323 | 0.92 | LTB4R2 (0.43) | LTB4R2BRS3MCL1PPARG | |
| SCHEMBL4651871 | 0.85 | LTB4R2 (0.46) | LTB4R2BRS3 | |
| SCHEMBL4651858 | 0.82 | LTB4R2 (0.46) | LTB4R2BRS3AGTR1 | |
| SCHEMBL9764278 | 0.82 | NFE2L2 (0.41) | LTB4R2 | |
| SCHEMBL9764275 | 0.82 | NFE2L2 (0.41) | LTB4R2 | |
| SCHEMBL9764355 | 0.81 | NFE2L2 (0.40) | LTB4R2 | |
| SCHEMBL9763570 | 0.81 | NFE2L2 (0.40) | LTB4R2 | |
| SCHEMBL9764351 | 0.81 | NFE2L2 (0.40) | LTB4R2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5211878-A | Difluorobenzonitrile derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-05-18 | — | — | US | disclosed |