Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNRHR | P30968 | 15/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28638656 | 0.84 | GNRHR (0.41) | GNRHRCYP3A4PDCD1CD274EGFR | |
| SCHEMBL28651462 | 0.84 | GNRHR (0.41) | GNRHRCYP3A4PDCD1CD274EGFR | |
| SCHEMBL28644101 | 0.82 | GNRHR (0.40) | GNRHRCYP3A4P2RX3PDCD1CD274 | |
| SCHEMBL28645661 | 0.82 | GNRHR (0.40) | GNRHRCYP3A4PDCD1CD274EGFR | |
| SCHEMBL28638881 | 0.82 | GNRHR (0.40) | GNRHRCYP3A4PDCD1CD274EGFR | |
| SCHEMBL28644084 | 0.81 | GNRHR (0.39) | GNRHRCYP3A4PDCD1CD274 | |
| SCHEMBL30178388 | 0.81 | GNRHR (0.39) | GNRHRCYP3A4PDCD1CD274EGFR | |
| SCHEMBL28660744 | 0.79 | GNRHR (0.40) | GNRHRCYP3A4 | |
| SCHEMBL28663476 | 0.78 | GNRHR (0.39) | GNRHRCYP3A4P2RX3PDCD1CD274 | |
| SCHEMBL28663474 | 0.78 | GNRHR (0.39) | GNRHRCYP3A4P2RX3PDCD1CD274 |
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-107428744-B | Novel heterocyclic compounds and their use in medicine and cosmetics | 盖尔德马研究及发展公司 | 2021-09-24 | — | — | CN | disclosed |