Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 14/20 | 0.47 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.45 |
| ▸ | CDK4 | P11802 | 1/20 | 0.45 |
| ▸ | CCND1 | P24385 | 1/20 | 0.45 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11343485 | 0.88 | FFAR1 (0.52) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL6645372 | 0.88 | FFAR1 (0.52) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL1533287 | 0.83 | FFAR1 (0.48) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL6231189 | 0.83 | FFAR1 (0.48) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL27725179 | 0.77 | CHRNB2 (0.50) | KMT2A | |
| SCHEMBL12082150 | 0.75 | FFAR1 (0.58) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL14220704 | 0.75 | FFAR1 (0.58) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL20193837 | 0.75 | FFAR1 (0.50) | FFAR1PPARGMEN1KMT2A | |
| SCHEMBL12082152 | 0.75 | FFAR1 (0.58) | FFAR1CCNE2CDK4CCND1CCNE1 | |
| SCHEMBL3067496 | 0.75 | CCNE2 (0.44) | FFAR1CCNE2CDK4CCND1CCNE1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107827852-B | Patchoulenone derivative and preparation method and application thereof | 成都中医药大学 | 2021-08-20 | — | — | CN | disclosed |