Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL21780716 | 0.90 | KDM4E (0.74) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL26640295 | 0.75 | KDM4E (0.46) | KDM4ELMNAGAANPSR1HPGD | |
| SCHEMBL21768425 | 0.73 | KDM4E (0.54) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL22637048 | 0.72 | KDM4E (0.56) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL30417 | 0.72 | LMNA (0.63) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL2220960 | 0.72 | LMNA (0.63) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL7797665 | 0.72 | LMNA (0.63) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL19105618 | 0.71 | KDM4E (0.55) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL22637689 | 0.71 | KDM4E (0.52) | KDM4ELMNATP53L3MBTL1POLB | |
| SCHEMBL12516787 | 0.71 | LMNA (0.62) | KDM4ELMNATP53L3MBTL1POLB |
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-3402781-B1 | 3-((HETERO-)ARYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2020-03-04 | — | — | EP | disclosed |