Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 4/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 8/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 8/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 8/20 | 0.33 |
| ▸ | CHRNB3 | Q05901 | 4/20 | 0.33 |
| ▸ | CHRNA6 | Q15825 | 4/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27879636 | 0.78 | CHRM2 (0.37) | — | |
| SCHEMBL27896386 | 0.78 | TSHR (0.44) | — | |
| SCHEMBL28232406 | 0.75 | HSD17B10 (0.47) | — | |
| SCHEMBL7408815 | 0.75 | POLB (0.36) | — | |
| SCHEMBL27896441 | 0.75 | EPHX2 (0.38) | — | |
| SCHEMBL28826381 | 0.74 | DPP4 (0.40) | — | |
| SCHEMBL27896434 | 0.74 | CYP3A4 (0.39) | ACE | |
| SCHEMBL12050723 | 0.74 | MAPK1 (0.41) | — | |
| SCHEMBL28054657 | 0.73 | DPP4 (0.55) | — | |
| SCHEMBL28054834 | 0.73 | DPP4 (0.55) | — |
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-102791693-A | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2012-11-21 | — | — | CN | claimed |