Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | PGR | P06401 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 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 | |
|---|---|---|---|---|
| SCHEMBL11283361 | 0.84 | TDP1 (0.55) | LMNAHPGDALDH1A1PDE4AHTT | |
| SCHEMBL28062466 | 0.84 | LMNA (0.46) | LMNACYP1A2PGRHPGDSLC6A2 | |
| SCHEMBL11246241 | 0.83 | CPS1 (0.50) | LMNACYP1A2PGRHPGDSLC6A2 | |
| SCHEMBL9056011 | 0.81 | MAPT (0.53) | LMNAALDH1A1HTTL3MBTL1TDP1 | |
| SCHEMBL9559907 | 0.79 | ALDH1A1 (0.49) | LMNACYP1A2PGRHPGDSLC6A2 | |
| SCHEMBL11224343 | 0.78 | LMNA (0.55) | LMNAHPGDALDH1A1CYP2D6MAPK1 | |
| SCHEMBL22807498 | 0.78 | POLB (0.47) | LMNAHPGDALDH1A1MAPK1CES2 | |
| SCHEMBL27939668 | 0.78 | CES2 (0.47) | LMNAALDH1A1MAPK1CES2CES1 | |
| SCHEMBL9850347 | 0.78 | ABL1 (0.47) | LMNACYP1A2HPGDCYP2C19ALDH1A1 | |
| SCHEMBL17709653 | 0.77 | ALDH1A1 (0.60) | LMNAHPGDALDH1A1MAPK1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105518001-A | MODIFIED BET-PROTEIN-INHIBITING DIHYDROQUINOXALINONES AND DIHYDROPYRIDOPYRAZINONES | Bayer Pharma AG | 2016-04-20 | — | — | CN | disclosed |
| EP-0433112-A1 | Modified gangliosides and the functional derivatives thereof | FIDIA S.p.A. (IT) | 1991-06-19 | — | — | EP | disclosed |