Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 7/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.35 |
| ▸ | GABRR2 | P28476 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | GABRR3 | A8MPY1 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL13497214 | 0.80 | HCAR2 (0.42) | HCAR2GABRR1GABRR2BLMGABRR3 | |
| SCHEMBL3391720 | 0.80 | HCAR2 (0.42) | HCAR2GABRR1GABRR2BLMGABRR3 | |
| SCHEMBL3391723 | 0.80 | HCAR2 (0.42) | HCAR2GABRR1GABRR2BLMGABRR3 | |
| SCHEMBL10952332 | 0.74 | TSHR (0.39) | HCAR2GABRR1GABRR2BLMGABRR3 | |
| SCHEMBL28502958 | 0.73 | HCAR2 (0.36) | HCAR2GABRR1GABRR2BLMGABRR3 | |
| SCHEMBL10991515 | 0.73 | — | — | |
| SCHEMBL277662 | 0.70 | — | — | |
| SCHEMBL15352 | 0.68 | — | — | |
| SCHEMBL12973059 | 0.68 | — | — | |
| SCHEMBL15353 | 0.68 | — | — |
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-109293513-B | Preparation method of sitafloxacin intermediate | 江西富祥药业股份有限公司 | 2021-10-08 | — | — | CN | disclosed |