Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 7/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | DNTT | P04053 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11065677 | 0.88 | ALDH1A1 (0.38) | ALDH1A1CYP1A2HIF1ABRD4NPSR1 | |
| SCHEMBL11065468 | 0.80 | DNTT (0.36) | ALDH1A1CYP1A2HIF1ABRD4NPSR1 | |
| SCHEMBL1577521 | 0.80 | ALDH1A1 (0.51) | ALDH1A1CYP1A2HIF1ABRD4NPSR1 | |
| SCHEMBL11062607 | 0.75 | ALDH1A1 (0.49) | ALDH1A1CYP1A2HIF1ABRD4RAB9A | |
| SCHEMBL11062963 | 0.75 | DNTT (0.37) | ALDH1A1CYP1A2HIF1ABRD4NPSR1 | |
| SCHEMBL11059939 | 0.74 | CYP1A2 (0.41) | ALDH1A1CYP1A2HIF1ABRD4RAB9A | |
| SCHEMBL11061933 | 0.72 | ALDH1A1 (0.47) | ALDH1A1CYP1A2HIF1ABRD4NPSR1 | |
| SCHEMBL3661760 | 0.71 | CYP1A2 (0.40) | ALDH1A1CYP1A2HIF1ABRD4TSHR | |
| SCHEMBL11061158 | 0.70 | CYP1A2 (0.37) | ALDH1A1CYP1A2HIF1ANPSR1TSHR | |
| SCHEMBL11064654 | 0.69 | CYP1A2 (0.35) | ALDH1A1CYP1A2HIF1ABRD4DNTT |
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 |