Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 3/20 | 0.60 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.50 |
| ▸ | MCHR1 | Q99705 | 10/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL436520 | 0.82 | CYP2D6 (0.41) | NR4A2MCHR1NOS3NOS1NOS2 | |
| SCHEMBL438225 | 0.82 | MCHR1 (0.42) | NR4A2MCHR1MAPTNOS3NOS1 | |
| SCHEMBL440380 | 0.82 | ALDH1A1 (0.49) | NR4A2MCHR1NOS3NOS1NOS2 | |
| SCHEMBL439885 | 0.81 | NOS3 (0.41) | NR4A2MCHR1NOS3NOS1NOS2 | |
| SCHEMBL439708 | 0.80 | MCHR1 (0.43) | NR4A2MCHR1MAPTACHENOS3 | |
| SCHEMBL436808 | 0.79 | CTSK (0.45) | MCHR1ACHE | |
| SCHEMBL438754 | 0.79 | HSP90AB1 (0.52) | HSP90AB1MCHR1KDM4EPARP1 | |
| SCHEMBL438834 | 0.79 | NOS2 (0.50) | NR4A2HSP90AB1MCHR1MAPTNOS3 | |
| SCHEMBL436991 | 0.78 | NOS3 (0.41) | NR4A2HSP90AB1MCHR1MAPTNOS3 | |
| SCHEMBL438980 | 0.76 | NR4A2 (1.00) | NR4A2MAPTACHEKDM4EPARP1 |
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 |