Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7911425 | 0.83 | CES1 (0.49) | CYP2D6CES1CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL11295018 | 0.82 | CES1 (0.57) | CYP2D6BLMKDM4EPOLBOPRM1 | |
| SCHEMBL868096 | 0.80 | CES1 (0.51) | CYP2D6CES1CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL10456740 | 0.79 | CES1 (0.59) | CYP2D6POLBCES1CYP1A2CYP2C19 | |
| SCHEMBL1255415 | 0.77 | LMNA (0.50) | CYP2D6OPRM1DRD3CHRM2CES1 | |
| SCHEMBL914317 | 0.77 | CES1 (0.43) | CYP2D6CES1CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL11547489 | 0.76 | CES1 (0.39) | CYP2D6POLBCES1ALDH1A1MEN1 | |
| SCHEMBL11587031 | 0.76 | CES1 (0.39) | CYP2D6POLBCHRM2CES1CYP1A2 | |
| SCHEMBL5574740 | 0.74 | CES1 (0.49) | CYP2D6CES1CYP2C19ALDH1A1MEN1 | |
| SCHEMBL8134337 | 0.74 | KDM4E (0.51) | CYP2D6BLMKDM4EPOLBOPRM1 |
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-5962743-A | Process for preparing acylaromatic compounds | CATALYTICA PHARMACEUTICALS, INC. (US) | 1999-10-05 | — | — | US | disclosed |