Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CBFB | Q13951 | 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 | |
|---|---|---|---|---|
| SCHEMBL439580 | 0.83 | BCHE (0.40) | BCHEACHEGRIN1GRIN2AALDH1A1 | |
| SCHEMBL438876 | 0.83 | BCHE (0.43) | BCHEACHEGRIN1GRIN2AALDH1A1 | |
| SCHEMBL441217 | 0.81 | KDM4E (0.36) | BCHEACHEGRIN1GRIN2AALDH1A1 | |
| SCHEMBL441668 | 0.79 | GAA (0.41) | BCHEACHEGRIN1GRIN2AALDH1A1 | |
| SCHEMBL438978 | 0.78 | HAVCR2 (0.64) | BCHEACHEGRIN1GRIN2AALDH1A1 | |
| SCHEMBL29656787 | 0.72 | PDE5A (0.46) | BCHEACHEGRIN1GRIN2AALDH1A1 | |
| SCHEMBL441707 | 0.72 | HAVCR2 (0.63) | ACHEALDH1A1HAVCR2NR4A2PLAU | |
| SCHEMBL437457 | 0.72 | KDM4E (0.45) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL440416 | 0.72 | CDK8 (0.33) | ALDH1A1HAVCR2MAPT | |
| SCHEMBL10009710 | 0.71 | NR4A2 (0.59) | BCHEACHEGRIN1GRIN2AALDH1A1 |
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 |