Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 4/20 | 0.39 |
| ▸ | HTR7 | P34969 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | AKT2 | P31751 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2639688 | 0.89 | POLB (0.44) | GAACHRM2NPC1RAB9APOLB | |
| SCHEMBL5501520 | 0.83 | CHRM2 (0.43) | CHRM2NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL2639275 | 0.83 | CHRM2 (0.45) | GAACHRM2NPC1RAB9AKDM4E | |
| SCHEMBL6021912 | 0.82 | CHRM2 (0.56) | CHRM2NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL2639950 | 0.81 | CHRM2 (0.37) | GAACHRM2NPC1RAB9APOLB | |
| SCHEMBL6022395 | 0.78 | EPHX2 (0.36) | CHRM2KDM4EALDH1A1 | |
| SCHEMBL2639518 | 0.77 | NPC1 (0.45) | CHRM2NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6017445 | 0.76 | CHRM2 (0.39) | CHRM2POLBKDM4EALDH1A1 | |
| SCHEMBL5805321 | 0.76 | HDAC3 (0.40) | HTR1AHTR7DRD2HTR6 | |
| SCHEMBL6022372 | 0.76 | CHRM2 (0.33) | GAACHRM2NPC1RAB9AAKT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1723115-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2006-11-22 | — | — | EP | disclosed |
| WO-2005087737-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2005-09-22 | — | — | WO | disclosed |