Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.56 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.56 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.56 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL13073467 | 0.98 | CHRM2 (0.58) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL261644 | 0.87 | PIK3CD (0.58) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL11728588 | 0.86 | ADRA1B (0.56) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7265729 | 0.86 | CYP1A2 (0.55) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL19539137 | 0.84 | ADRA1B (0.55) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL16364962 | 0.82 | ADRA1B (0.50) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5531197 | 0.82 | KMT2A (0.53) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL11577651 | 0.81 | ADRA1D (0.46) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL21001577 | 0.81 | CYP1A2 (0.50) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL1778659 | 0.81 | KMT2A (0.82) | KMT2ACHRM2CHRM4CHRM5CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011058149-A1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-05-19 | — | — | WO | disclosed |