Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10304920 | 0.84 | CHRNB2 (0.33) | CHRNB2CHRNA4 | |
| SCHEMBL13745093 | 0.80 | — | — | |
| SCHEMBL13745328 | 0.80 | — | — | |
| SCHEMBL13745142 | 0.76 | DPP4 (0.36) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL10305065 | 0.74 | CHRNB2 (0.38) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL2530046 | 0.71 | CHRNB2 (0.31) | CHRNB2CHRNA4 | |
| SCHEMBL11611430 | 0.71 | CHRM2 (0.32) | CHRNB2CHRNA4 | |
| SCHEMBL4396215 | 0.68 | GABRR1 (0.35) | — | |
| SCHEMBL14744183 | 0.67 | DDAH1 (0.34) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL3222748 | 0.67 | CHRNB2 (0.31) | CHRNB2CHRNA4CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009097578-A1 | OXIM DERIVATIVES AS HSP90 INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-08-06 | — | — | WO | disclosed |