Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.72 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | PLA2G4B | P0C869 | 3/20 | 0.62 |
| ▸ | FAAH | O00519 | 6/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.57 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8943242 | 1.00 | RARB (0.72) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL9436019 | 1.00 | RARB (0.72) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL6899502 | 0.98 | RARB (0.69) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL9670519 | 0.95 | TP53 (0.70) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL79521 | 0.95 | TP53 (0.70) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL9671383 | 0.93 | TP53 (0.67) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL8292097 | 0.90 | TP53 (0.61) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL11289645 | 0.86 | GAA (0.57) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL17319274 | 0.86 | RARB (0.66) | RARBTP53TSHRPLA2G4BFAAH | |
| SCHEMBL10683689 | 0.85 | HDAC1 (0.53) | RARBTP53TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0435989-B1 | PROCESS FOR THE PREPARATION OF AROMATIC NITRILES | MERCK PATENT GMBH (DE) | 1994-09-14 | — | — | EP | disclosed |
| EP-0435989-A1 | PROCESS FOR THE PREPARATION OF AROMATIC NITRILES. | MERCK PATENT GMBH (DE) | 1991-07-10 | — | — | EP | disclosed |
| WO-1991001298-A1 | PROCESS FOR THE PREPARATION OF AROMATIC NITRILES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-02-07 | — | — | WO | disclosed |