Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | BACE1 | P56817 | 2/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | RB1 | P06400 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11878 | 0.90 | LTA4H (0.56) | ACHEBACE1LTA4HBCHEHRH3 | |
| SCHEMBL14848246 | 0.90 | ACHE (0.54) | ACHEBACE1BCHEHRH3SMN1; SMN2 | |
| SCHEMBL20804106 | 0.86 | ACHE (0.49) | ACHEBACE1BCHEHRH3SMN1; SMN2 | |
| SCHEMBL32675244 | 0.83 | GRIN2B (0.54) | ACHEBACE1LTA4HBCHEOPRM1 | |
| SCHEMBL3937405 | 0.83 | GRIN2B (0.54) | ACHEBACE1LTA4HBCHEOPRM1 | |
| SCHEMBL12449603 | 0.83 | KDM1A (0.46) | LTA4HHRH3SMN1; SMN2NPSR1OPRM1 | |
| SCHEMBL2731922 | 0.80 | ACHE (0.61) | ACHEBACE1BCHEHRH3SMN1; SMN2 | |
| SCHEMBL16286711 | 0.80 | EGLN2 (0.44) | LTA4HHRH3SMN1; SMN2OPRM1OPRK1 | |
| SCHEMBL19650797 | 0.80 | BCHE (0.51) | ACHEBACE1LTA4HBCHEHRH3 | |
| SCHEMBL16286710 | 0.80 | EGLN2 (0.44) | LTA4HHRH3SMN1; SMN2OPRM1OPRK1 |
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 |