Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25124451 | 0.79 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1HPGDHTTCSNK2A1 | |
| SCHEMBL13922750 | 0.77 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1HPGDHTTCSNK2A1 | |
| SCHEMBL10184215 | 0.76 | FTO (0.50) | SMN1; SMN2ALDH1A1HPGDHTTCSNK2A1 | |
| SCHEMBL1004649 | 0.73 | ALDH1A1 (0.73) | SMN1; SMN2ALDH1A1HPGDHTTEPHX2 | |
| SCHEMBL5013530 | 0.72 | ALDH1A1 (0.55) | SMN1; SMN2ALDH1A1HPGDHTTCSNK2A1 | |
| SCHEMBL19459308 | 0.72 | ALDH1A1 (0.55) | SMN1; SMN2ALDH1A1HPGDHTTCSNK2A1 | |
| SCHEMBL16016478 | 0.72 | ALDH1A1 (0.54) | SMN1; SMN2ALDH1A1HPGDHTTEPHX2 | |
| SCHEMBL855667 | 0.71 | ALDH1A1 (0.58) | SMN1; SMN2ALDH1A1HPGDHTTEPHX2 | |
| SCHEMBL11070846 | 0.71 | LMNA (0.53) | CYP1A2CYP3A4MAPK1L3MBTL1 | |
| SCHEMBL4180423 | 0.71 | NR1H4 (0.43) | SMN1; SMN2ALDH1A1HPGDHTTCSNK2A1 |
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-2017121444-A1 | QUINOLIN-2-ONE DERIVATIVES | MERCK PATENT GMBH (DE) | 2017-07-20 | — | — | WO | disclosed |