Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | GLI1 | P08151 | 1/20 | 0.40 |
| ▸ | GLI2 | P10070 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | RNF4 | P78317 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9862932 | 1.00 | ALDH1A1 (0.56) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9863147 | 0.90 | ALDH1A1 (0.55) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9863148 | 0.90 | ALDH1A1 (0.55) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9862890 | 0.87 | ALDH1A1 (0.53) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9862889 | 0.87 | ALDH1A1 (0.53) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9863144 | 0.86 | TDP1 (0.53) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9863150 | 0.86 | TDP1 (0.53) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL5161874 | 0.85 | ALDH1A1 (0.54) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL11045825 | 0.85 | ALDH1A1 (0.54) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL5161879 | 0.85 | ALDH1A1 (0.54) | ALDH1A1TDP1PTGS1MEN1CYP2D6 |
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-4985365-A | WITH AN ESTERASE FROM A MICROORGANISM, ASSYMETRIC HYDROLYSIS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1991-01-15 | — | — | US | disclosed |
| EP-0118163-B1 | METHOD FOR BIOTECHNOLOGICALLY PREPARING OPTICALLY ACTIVE ALPHA-CYANO-3-PHENOXYBENZYL ALCOHOL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-04-20 | — | — | EP | disclosed |
| EP-0118163-A1 | Method for biotechnologically preparing optically active alpha-cyano-3-phenoxybenzyl alcohol | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1984-09-12 | — | — | EP | disclosed |