Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.49 |
| ▸ | CCR2 | P41597 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1804779 | 0.92 | ACHE (0.48) | BCHEALDH1A1CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL1235952 | 0.92 | ACHE (0.48) | BCHEALDH1A1CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL20722666 | 0.89 | SIGMAR1 (0.47) | BCHEALDH1A1CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL28385966 | 0.87 | BCHE (0.57) | BCHEALDH1A1CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL12099306 | 0.84 | ACHE (0.54) | BCHEDRD2 | |
| SCHEMBL20037572 | 0.81 | MCHR1 (0.39) | BCHEROCK1ROCK2KCNH2 | |
| SCHEMBL18081018 | 0.79 | BCHE (0.61) | BCHEALDH1A1CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL25217562 | 0.79 | FUCA1 (0.38) | BCHEMAOBDRD2 | |
| SCHEMBL1868761 | 0.79 | FUCA1 (0.44) | BCHEALDH1A1MAOB | |
| SCHEMBL19465332 | 0.79 | FUCA1 (0.44) | BCHEALDH1A1MAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-6828427-B1 | Oligomeric aminodiol-containing compounds, libraries thereof, and process of preparing the same | ISIS PHARMACEUTICALS, INC. | 2004-12-07 | — | — | US | disclosed |
| US-6184389-B1 | FEATURE A PLURALITY OF FUNCTIONAL GROUPS ATTACHED TO BACKBONE AND PHOSPHORAMIDATE SITES | ISIS PHARMACEUTICALS, INC. | 2001-02-06 | — | — | US | disclosed |