Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.58 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9610966 | 0.93 | ALDH1A1 (0.68) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL9509003 | 0.92 | LMNA (0.51) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL11684902 | 0.91 | LMNA (0.55) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL16933991 | 0.90 | LMNA (0.62) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL873641 | 0.89 | ALDH1A1 (0.54) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL28975665 | 0.89 | ALDH1A1 (0.76) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL4067111 | 0.89 | ALDH1A1 (0.76) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL9510184 | 0.87 | MEN1 (0.57) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL27937179 | 0.87 | ALDH1A1 (0.53) | LMNASMN1; SMN2MEN1USP2ALDH1A1 | |
| SCHEMBL19043546 | 0.86 | MEN1 (0.63) | LMNASMN1; SMN2MEN1USP2ALDH1A1 |
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-2938344-B1 | PIPERAZINE-SUBSTITUTED [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME (US) | 2017-06-21 | — | — | EP | disclosed |