Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 2/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | GPR3 | P46089 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 6/20 | 0.31 |
| ▸ | PTGES | O14684 | 2/20 | 0.31 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20176718 | 0.91 | GCGR (0.36) | RARBGCGRS1PR1GPR3TLR8 | |
| SCHEMBL24990318 | 0.90 | GCGR (0.31) | GCGR | |
| SCHEMBL25070488 | 0.90 | — | — | |
| SCHEMBL24990323 | 0.89 | GCGR (0.30) | GCGR | |
| SCHEMBL18217177 | 0.88 | — | — | |
| SCHEMBL20176729 | 0.87 | RARB (0.35) | RARBGCGRS1PR1GPR3SPHK2 | |
| SCHEMBL25070324 | 0.87 | ESR1 (0.30) | ESR1ESR2 | |
| SCHEMBL17694364 | 0.86 | RARB (0.36) | RARBGCGRS1PR1GPR3TLR8 | |
| SCHEMBL25070578 | 0.86 | CRHR1 (0.30) | — | |
| SCHEMBL17694315 | 0.85 | RARB (0.40) | RARBGCGRS1PR1GPR3TLR8 |
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-20180142153-A1 | THIADIAZOLOQUINOXALINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2018-05-24 | — | — | US | disclosed |