Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 8/20 | 0.52 |
| ▸ | CES1 | P23141 | 7/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | XBP1 | P17861 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9388831 | 0.82 | SMN1; SMN2 (0.47) | CES2CES1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL14397456 | 0.82 | LMNA (0.54) | CES2CES1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL6749595 | 0.80 | SMN1; SMN2 (0.48) | SMN1; SMN2LMNANPSR1MAPTXBP1 | |
| SCHEMBL26347289 | 0.80 | ALDH1A1 (0.49) | SMN1; SMN2LMNANPSR1MAPTXBP1 | |
| SCHEMBL8802723 | 0.80 | CES2 (0.56) | CES2CES1SMN1; SMN2LMNAMAPT | |
| SCHEMBL24998749 | 0.78 | MLYCD (0.58) | SMN1; SMN2LMNANPSR1ALDH1A1CYP1A2 | |
| SCHEMBL155518 | 0.78 | MLYCD (0.58) | SMN1; SMN2LMNANPSR1ALDH1A1CYP1A2 | |
| SCHEMBL29772431 | 0.78 | MLYCD (0.58) | SMN1; SMN2LMNANPSR1ALDH1A1CYP1A2 | |
| SCHEMBL13875459 | 0.78 | MEN1 (0.52) | CES2CES1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL27432290 | 0.78 | SMN1; SMN2 (0.43) | CES2CES1SMN1; SMN2LMNANPSR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9951058-B2 | Compound, pharmaceutically acceptable salt or optical isomer thereof, method for preparing the same, and pharmaceutical composition for prevention or treatment of viral diseases containing same as active ingredient | KATHOLIEKE UNIVERSITEIT LEUVEN K.U. LEUVEN R & D (BE) | 2018-04-24 | — | — | US | disclosed |
| US-9790197-B2 | Compound, pharmaceutically acceptable salt or optical isomer thereof, method for preparing the same, and pharmaceutical composition for prevention or treatment of viral diseases containing same as active ingredient | KATHOLIEKE UNIVERSITEIT LEUVEN K.U. LEUVEN R & D (BE) | 2017-10-17 | — | — | US | disclosed |
| US-9790197-B2 | Compound, pharmaceutically acceptable salt or optical isomer thereof, method for preparing the same, and pharmaceutical composition for prevention or treatment of viral diseases containing same as active ingredient | KATHOLIEKE UNIVERSITEIT LEUVEN K.U. LEUVEN R & D (BE) | 2017-10-17 | — | — | US | disclosed |
| EP-1836002-B1 | PROCESS FOR THE PRODUCTION OF STRONGLY ADHERENT COATINGS | BASF SE (DE) | 2012-08-29 | — | — | EP | disclosed |