Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 1/20 | 0.35 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9827651 | 0.78 | P2RX7 (0.34) | P2RX7 | |
| SCHEMBL5728688 | 0.77 | — | — | |
| SCHEMBL17741957 | 0.75 | — | — | |
| SCHEMBL14749789 | 0.75 | — | — | |
| SCHEMBL9803351 | 0.72 | PER2 (0.37) | PER2CRY2P2RX7 | |
| SCHEMBL14749807 | 0.72 | PER2 (0.37) | PER2CRY2P2RX7 | |
| SCHEMBL6285666 | 0.71 | KMT2A (0.39) | PER2CRY2P2RX7 | |
| SCHEMBL20733251 | 0.71 | PER2 (0.36) | PER2CRY2P2RX7 | |
| SCHEMBL9826474 | 0.69 | ATM (0.39) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL11731840 | 0.69 | CHRM2 (0.58) | PER2CRY2TSHRCHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0440670-A1 | HETEROCYCLIC ACETYLENIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY. | UPJOHN CO (US) | 1991-08-14 | — | — | EP | disclosed |