Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23283481 | 0.88 | ACHE (0.46) | ACHECYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL441705 | 0.83 | CTSS (0.45) | SMN1; SMN2MCHR1CYP3A4CYP1A2HSD17B10 | |
| SCHEMBL3626501 | 0.82 | KDM4E (0.43) | CYP2D6DRD1HTR2AADORA1TLR7 | |
| SCHEMBL439432 | 0.79 | MCHR1 (0.49) | KCNH2MCHR1 | |
| SCHEMBL439615 | 0.79 | NR4A2 (0.59) | TLR7MCHR1 | |
| SCHEMBL437548 | 0.79 | MCHR1 (0.49) | ACHEKDM4EMCHR1SREBF2 | |
| SCHEMBL438970 | 0.76 | NR4A2 (0.60) | ACHEKDM4EALDH1A1SMN1; SMN2APP | |
| SCHEMBL441586 | 0.76 | KDM4E (0.60) | ACHETLR7KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL439523 | 0.75 | MCHR1 (0.57) | MCHR1 | |
| SCHEMBL436437 | 0.72 | MCHR1 (0.51) | ALDH1A1SMN1; SMN2MCHR1CYP3A4CYP1A2 |
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 |