Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 14/20 | 0.61 |
| ▸ | CCND1 | P24385 | 14/20 | 0.61 |
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.48 |
| ▸ | CFTR | P13569 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30561940 | 0.84 | CDK4 (0.51) | CDK4CCND1GFERTRPV1FAAH | |
| SCHEMBL13942347 | 0.84 | CDK4 (0.83) | CDK4CCND1TRPV1FAAH | |
| SCHEMBL30561933 | 0.76 | CDK4 (0.52) | CDK4CCND1TRPV1 | |
| SCHEMBL30561951 | 0.76 | CDK4 (0.51) | CDK4CCND1TRPV1 | |
| SCHEMBL13942739 | 0.76 | CDK4 (1.00) | CDK4CCND1TRPV1 | |
| SCHEMBL30561941 | 0.73 | CDK4 (0.48) | CDK4CCND1TRPV1 | |
| SCHEMBL3941869 | 0.71 | GFER (1.00) | GFER | |
| SCHEMBL4972251 | 0.71 | GFER (0.94) | GFER | |
| SCHEMBL30317424 | 0.71 | GFER (1.00) | GFER | |
| SCHEMBL21588274 | 0.71 | TRPV1 (0.48) | CDK4CCND1TRPV1CFTRFAAH |
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-116836160-A | Fluoro-phenylacetyl tetrahydro-beta-carboline micromolecule organic compound for targeting tumor dryness and medical application thereof | 华东师范大学 | 2023-10-03 | — | — | CN | disclosed |