Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | RORA | P35398 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | RORB | Q92753 | 1/20 | 0.32 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | TLR7 | Q9NYK1 | 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 | |
|---|---|---|---|---|
| SCHEMBL14737554 | 0.82 | TLR8 (0.36) | TLR8ESR1ADORA2AADORA2BPGR | |
| SCHEMBL14738535 | 0.81 | SYK (0.38) | TLR8ESR1ADORA2AADORA2BPGR | |
| SCHEMBL14737417 | 0.80 | TLR8 (0.41) | TLR8ESR1ADORA2AADORA2BPGR | |
| SCHEMBL14737310 | 0.70 | KMO (0.38) | ESR1ADORA2AADORA2B | |
| SCHEMBL14738413 | 0.66 | PSEN1 (0.40) | ESR1ADORA2AADORA2BPGRRORA | |
| SCHEMBL14738255 | 0.66 | ICMT (0.38) | TLR8MAPTHTR2CSLC6A4 | |
| SCHEMBL14738694 | 0.66 | MAPK8 (0.37) | — | |
| SCHEMBL17189068 | 0.65 | TLR8 (0.36) | TLR8ESR1ADORA2AADORA2B | |
| SCHEMBL14737720 | 0.65 | PGR (0.39) | TLR8PGRRORARORCRORB | |
| Ammonia Solution, Strong SCHEMBL27629366 | 0.65 | ADORA2A (0.50) | TLR8ESR1ADORA2AADORA2BMAPT |
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-104024258-A | Pyrrolopyrazine kinase inhibitors | HOFFMANN LA ROCHE | 2014-09-03 | — | — | CN | disclosed |