Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11066052 | 0.87 | TSHR (0.33) | CHRNB2CHRNA4CHRNA3SMN1; SMN2ALDH1A1 | |
| SCHEMBL11055929 | 0.78 | BRD4 (0.33) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11062133 | 0.77 | ALDH1A1 (0.34) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL5896745 | 0.71 | CYP1A2 (0.38) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL857295 | 0.71 | TLR4 (0.48) | BRD4KMT2AALDH1A1KDM4EMAPT | |
| SCHEMBL11061482 | 0.71 | TSHR (0.33) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL7715093 | 0.71 | BRD4 (0.46) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11059934 | 0.69 | TSHR (0.33) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL11065757 | 0.69 | TSHR (0.33) | SMN1; SMN2 | |
| SCHEMBL31405426 | 0.68 | BRD4 (0.39) | BRD4CHRNB2CHRNA4CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4432378-A | ORGANOLEPTIC; TOBACCO; FOODS; DETERGENTS; COSMETICS | FRITZSCHE, DODGE & OLCOTT, INC. (US) | 1984-02-21 | — | — | US | disclosed |
| US-4326996-A | FOR PERFUMES | FRITZSCHE DODGE & OLCOTT INC. (US) | 1982-04-27 | — | — | US | disclosed |
| US-4281204-A | ALKYLATION, DECARBOXYLATION TO CYCLIZE | FRITZSCHE DODGE & OLCOTT INC. (US) | 1981-07-28 | — | — | US | disclosed |