Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12372 | 0.83 | ALDH1A1 (0.49) | CHRM2CHRM3ALDH1A1KDM4EMAPT | |
| SCHEMBL18082561 | 0.82 | HRH3 (0.50) | CHRM2CHRM3ALDH1A1KDM4EMAPT | |
| SCHEMBL31546411 | 0.81 | HRH3 (0.69) | ALDH1A1KDM4EMAPTHTT | |
| SCHEMBL12981 | 0.81 | HRH3 (0.69) | ALDH1A1KDM4EMAPTHTT | |
| SCHEMBL13460104 | 0.81 | PRMT6 (0.46) | CHRM2CHRM3ALDH1A1KDM4E | |
| SCHEMBL15006837 | 0.81 | SMN1; SMN2 (0.66) | ALDH1A1KDM4EHTTFAAH | |
| SCHEMBL13489987 | 0.80 | ACKR3 (0.45) | ALDH1A1LMNAFAAH | |
| SCHEMBL12449576 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNA | |
| SCHEMBL12373 | 0.80 | ALDH1A1 (0.59) | ALDH1A1KDM4EHTTLMNA | |
| SCHEMBL12854 | 0.80 | HRH3 (0.67) | ALDH1A1KDM4EMAPTHTT |
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-2499146-B1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO SA (CH) | 2016-09-21 | — | — | EP | disclosed |
| WO-2011058149-A1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-05-19 | — | — | WO | disclosed |