Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TLR4 | O00206 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.40 |
| ▸ | GLI1 | P08151 | 1/20 | 0.40 |
| ▸ | GLI2 | P10070 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9863162 | 1.00 | ALDH1A1 (0.59) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL10397026 | 1.00 | ALDH1A1 (0.59) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9078621 | 0.89 | ALDH1A1 (0.53) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL15151142 | 0.86 | PTGS1 (0.58) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9863147 | 0.85 | ALDH1A1 (0.55) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL9863148 | 0.85 | ALDH1A1 (0.55) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL7699172 | 0.83 | ALDH1A1 (0.50) | ALDH1A1TDP1MEN1CYP2D6KMT2A | |
| SCHEMBL2835326 | 0.83 | ALDH1A1 (0.50) | ALDH1A1TDP1MEN1CYP2D6KMT2A | |
| SCHEMBL10992657 | 0.83 | ALDH1A1 (0.54) | ALDH1A1TDP1PTGS1MEN1CYP2D6 | |
| SCHEMBL11238071 | 0.83 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4234505-A | Process for preparing cyanohydrin esters | STAUFFER CHEMICAL COMPANY (US) | 1980-11-18 | — | — | US | claimed |
| US-4985365-A | WITH AN ESTERASE FROM A MICROORGANISM, ASSYMETRIC HYDROLYSIS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1991-01-15 | — | — | US | disclosed |
| US-4897357-A | ASYMMETRIC HYDROLYSIS OF RACEMIC MIXTURE USING MICROORGANISM-PRODUCED ENZYME | ETHYL CORPORATION (US) | 1990-01-30 | — | — | US | disclosed |
| US-4827013-A | (S) α-(cyano-3-phenoxy-benzyl acetate | ETHYL CORPORATION (US) | 1989-05-02 | — | — | US | disclosed |
| EP-0080827-B1 | METHOD FOR BIOTECHNOLOGICALLY PREPARING (S)-(-)-ALPHA-CYANO-3-PHENOXYBENZYL ALCOHOL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-03-09 | — | — | EP | disclosed |
| EP-0230599-A1 | (S) Alpha-cyano-3-phenoxy benzyl acetate | ETHYL CORPORATION (US) | 1987-08-05 | — | — | EP | disclosed |
| EP-0080827-A2 | Method for biotechnologically preparing (S)-(-)-alpha-cyano-3-phenoxybenzyl alcohol | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1983-06-08 | — | — | EP | disclosed |
| US-4234506-A | Process for preparing cyanohydrin esters | STAUFFER CHEMICAL COMPANY (US) | 1980-11-18 | — | — | US | disclosed |
| US-4234505-A | Process for preparing cyanohydrin esters | STAUFFER CHEMICAL COMPANY (US) | 1980-11-18 | — | — | US | disclosed |
| US-4234507-A | Process for preparing cyanohydrin esters | STAUFFER CHEMICAL COMPANY (US) | 1980-11-18 | — | — | US | disclosed |
| US-4234508-A | Process for preparing cyanohydrin esters | STAUFFER CHEMICAL COMPANY (US) | 1980-11-18 | — | — | US | disclosed |