Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13631419 | 0.84 | CYP2C19 (0.69) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL18759302 | 0.82 | CYP2C19 (0.65) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL16215617 | 0.82 | CYP2C19 (0.60) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL8267306 | 0.82 | LMNA (0.62) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL10207505 | 0.81 | CYP2C19 (0.59) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL10707490 | 0.81 | CYP2C19 (0.63) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL828143 | 0.81 | POLB (0.61) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL2827515 | 0.79 | MAPT (0.65) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL6967481 | 0.79 | MAPT (0.65) | CYP2C19CYP1A2CYP2D6MAPTGAA | |
| SCHEMBL1021659 | 0.79 | CYP2C19 (0.57) | CYP2C19CYP1A2CYP2D6MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |