Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.38 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9070294 | 0.94 | ALDH1A1 (0.59) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| Hydrochloric Acid SCHEMBL9781178 | 0.92 | ALDH1A1 (0.57) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL2372933 | 0.78 | CYP3A4 (0.46) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL7519140 | 0.78 | ALDH1A1 (0.44) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL9764667 | 0.77 | ALDH1A1 (0.58) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL30705082 | 0.76 | MKNK1 (0.60) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL15508012 | 0.76 | MKNK1 (0.60) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL1341730 | 0.76 | CYP3A4 (0.48) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL9621692 | 0.76 | ALDH1A1 (0.56) | ALDH1A1CYP3A4HSD17B10TDP1TSHR | |
| SCHEMBL31304152 | 0.75 | MKNK1 (0.61) | ALDH1A1CYP3A4HSD17B10TDP1TSHR |
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-4696675-A | Process for preparing water-insoluble blue azo dyes on the fiber: hydroxynaphthoic amide and diazotized di-alkoxy-benzidine | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-09-29 | — | — | US | disclosed |