Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | SRC | P12931 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 7/20 | 0.47 |
| ▸ | MAOB | P27338 | 7/20 | 0.47 |
| ▸ | UNG | P13051 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9077640 | 0.87 | RELA (0.46) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL8579838 | 0.85 | SRC (0.58) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL8577513 | 0.85 | SRC (0.58) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL20958113 | 0.83 | SRC (0.56) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL10582261 | 0.82 | SRC (0.51) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL2489203 | 0.82 | KMT2A (0.60) | NPC1KMT2ARAB9APOLBMEN1 | |
| SCHEMBL31738388 | 0.81 | SRC (0.54) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL29456918 | 0.81 | CYP3A4 (0.59) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL2094506 | 0.81 | CYP3A4 (0.59) | NPC1KMT2ARAB9AGAAMAPT | |
| SCHEMBL3821816 | 0.81 | KMT2A (0.68) | NPC1KMT2ARAB9AGAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4376731-A | 2-NITRILES THEREOF | BOEHRINGER MANNHEIM GMBH (DE) | 1983-03-15 | — | — | US | disclosed |