Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29733508 | 0.96 | ACHE (0.44) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL331098 | 0.96 | ACHE (0.44) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL30242039 | 0.96 | ACHE (0.44) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL28775867 | 0.94 | ACHE (0.42) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL31651413 | 0.94 | ACHE (0.42) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL4110376 | 0.89 | HSD17B1 (0.42) | ACHESIGMAR1ALDH1A1NPC1RAB9A | |
| SCHEMBL21816961 | 0.86 | ACHE (0.39) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL3877943 | 0.86 | ACHE (0.39) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL977663 | 0.85 | ACHE (0.58) | ACHESIGMAR1ALDH1A1MAPK1NPC1 | |
| SCHEMBL10128581 | 0.85 | ACHE (0.42) | ACHESIGMAR1ALDH1A1MAPK1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2291479-B1 | ADHESIVE ENCAPSULATING COMPOSITION AND ELECTRONIC DEVICES MADE THEREWITH | 3M INNOVATIVE PROPERTIES CO (US) | 2013-05-22 | — | — | EP | disclosed |
| US-5494765-A | Electrophotosensitive material using a phenylenediamine derivative | MITA INDUSTRIAL CO. LTD (JP) | 1996-02-27 | — | — | US | disclosed |