Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | MPL | P40238 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 12/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | F2R | P25116 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL438754 | 0.84 | HSP90AB1 (0.52) | MCHR1HSP90AB1PDE10A | |
| SCHEMBL436808 | 0.81 | CTSK (0.45) | CTSSCTSKMCHR1 | |
| SCHEMBL437125 | 0.80 | NR4A2 (0.55) | MPLADORA2AADORA1 | |
| SCHEMBL436520 | 0.78 | CYP2D6 (0.41) | MCHR1ADORA2AADORA1NOS3NOS1 | |
| SCHEMBL440380 | 0.75 | ALDH1A1 (0.49) | CTSSCTSKMCHR1ADORA1NOS3 | |
| SCHEMBL439825 | 0.75 | NR4A2 (0.60) | MCHR1HSP90AB1NOS3NOS1NOS2 | |
| SCHEMBL441705 | 0.73 | CTSS (0.45) | CTSSCTSKMCHR1 | |
| SCHEMBL436437 | 0.73 | MCHR1 (0.51) | CTSSCTSKMCHR1 | |
| SCHEMBL436015 | 0.70 | NOS3 (0.39) | CTSSCTSKMCHR1NOS3NOS1 | |
| SCHEMBL441586 | 0.68 | KDM4E (0.60) | MCHR1HSP90AB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |