Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL4723495 | 0.89 | P2RX7 (0.36) | CTSSP2RX7 | |
| SCHEMBL4723491 | 0.89 | P2RX7 (0.36) | CTSSP2RX7 | |
| SCHEMBL4721425 | 0.86 | F10 (0.33) | CTSS | |
| SCHEMBL4718895 | 0.81 | CYP3A4 (0.32) | NPSR1CYP3A4CYP2C9 | |
| SCHEMBL4721863 | 0.79 | EIF4EBP1 (0.33) | — | |
| SCHEMBL14101991 | 0.77 | TRPA1 (0.32) | — | |
| SCHEMBL4720381 | 0.76 | TRPA1 (0.33) | KDM4E | |
| SCHEMBL14101995 | 0.75 | F10 (0.38) | NPSR1CYP3A4CYP2C9KDM4EALDH1A1 | |
| SCHEMBL4722255 | 0.75 | F10 (0.37) | CTSSP2RX7 | |
| SCHEMBL4722250 | 0.75 | F10 (0.37) | CTSSP2RX7 |
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-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |