Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1194575 | 0.78 | CHRNB4 (0.36) | CHRNB4CHRNA3IDO1TDO2 | |
| SCHEMBL12263051 | 0.76 | GABRA1 (0.38) | CHRNB4CHRNA3IDO1TDO2 | |
| SCHEMBL17196435 | 0.74 | CHRNB4 (0.34) | CHRNB4CHRNA3 | |
| SCHEMBL29988864 | 0.74 | CHRNB4 (0.34) | CHRNB4CHRNA3 | |
| SCHEMBL3592509 | 0.74 | CHRNB4 (0.34) | CHRNB4CHRNA3 | |
| SCHEMBL1006029 | 0.73 | GBA1 (0.36) | CHRNB4CHRNA3IDO1TDO2 | |
| SCHEMBL28989624 | 0.73 | GABRA1 (0.35) | CHRNB4CHRNA3 | |
| SCHEMBL20145485 | 0.73 | GBA1 (0.36) | CHRNB4CHRNA3IDO1TDO2 | |
| SCHEMBL20764748 | 0.73 | CES2 (0.35) | CHRNB4CHRNA3 | |
| SCHEMBL2422394 | 0.73 | GABRA1 (0.35) | CHRNB4CHRNA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5315710-B2 | — | — | 2013-10-16 | — | — | JP | disclosed |
| JP-2009184976-A | METHOD FOR PRODUCING 1-BROMO-3-FLUORO-5-DIFLUOROMETHYLBENZENE | CENTRAL GLASS CO LTD | 2009-08-20 | — | — | JP | disclosed |