Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 14/20 | 0.33 |
| ▸ | CPT1A | P50416 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16179700 | 0.98 | SIRT2 (0.44) | SIRT2CYP19A1CPT1A | |
| SCHEMBL16193279 | 0.98 | SIRT2 (0.44) | SIRT2CYP19A1CPT1A | |
| SCHEMBL17582530 | 0.98 | SIRT2 (0.44) | SIRT2CYP19A1CPT1A | |
| SCHEMBL16193264 | 0.98 | SIRT2 (0.44) | SIRT2CYP19A1CPT1A | |
| SCHEMBL16179699 | 0.98 | SIRT2 (0.44) | SIRT2CYP19A1CPT1A | |
| SCHEMBL16317445 | 0.95 | SIRT2 (0.36) | SIRT2CYP19A1ESR1ESR2HSD17B10 | |
| SCHEMBL16193210 | 0.95 | SIRT2 (0.36) | SIRT2CYP19A1ESR1ESR2HSD17B10 | |
| SCHEMBL17582524 | 0.95 | SIRT2 (0.36) | SIRT2CYP19A1ESR1ESR2HSD17B10 | |
| SCHEMBL17582519 | 0.93 | SIRT2 (0.40) | SIRT2CYP19A1CPT1A | |
| SCHEMBL16193211 | 0.93 | SIRT2 (0.40) | SIRT2CYP19A1CPT1A |
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-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |