Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.53 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.53 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL8720323 | 0.83 | HRH3 (0.42) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL8716792 | 0.81 | ADRB2 (0.48) | CYP2D6CYP3A4CYP2C19KCNH2LMNA | |
| SCHEMBL13039134 | 0.80 | CYP2D6 (0.57) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL14269710 | 0.78 | KCNA5 (0.73) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL8002190 | 0.77 | CYP2D6 (0.53) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| Hydrochloric Acid SCHEMBL8002376 | 0.76 | CYP2D6 (0.52) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL8983562 | 0.75 | CYP2D6 (0.83) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL8983627 | 0.75 | CYP2D6 (0.83) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL7097730 | 0.75 | CYP2D6 (0.83) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 | |
| SCHEMBL506316 | 0.75 | CYP2D6 (0.61) | CYP2D6CYP1A2CYP3A4CYP2C19KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0569802-B1 | Arylacetamides | MERCK PATENT GMBH (DE) | 1998-07-15 | — | — | EP | disclosed |
| EP-0569802-A1 | Arylacetamides | MERCK PATENT GmbH (DE) | 1993-11-18 | — | — | EP | disclosed |