Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 1.00 |
| ▸ | CYP2C19 | P33261 | 2/20 | 1.00 |
| ▸ | MEN1 | O00255 | 1/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 1/20 | 1.00 |
| ▸ | NR2E1 | Q9Y466 | 5/20 | 0.73 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.64 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.64 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.64 |
| ▸ | HTR2B | P41595 | 3/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.64 |
| ▸ | HTR2A | P28223 | 3/20 | 0.64 |
| ▸ | HTR2C | P28335 | 3/20 | 0.64 |
| ▸ | HTR6 | P50406 | 3/20 | 0.64 |
| ▸ | LMNA | P02545 | 3/20 | 0.64 |
| ▸ | SCN1A | P35498 | 2/20 | 0.64 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL6483890 | 1.00 | CYP1A2 (1.00) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL6483883 | 1.00 | CYP1A2 (1.00) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL29437209 | 1.00 | CYP1A2 (1.00) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL1394219 | 0.91 | CYP1A2 (0.83) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL29437208 | 0.91 | CYP1A2 (0.83) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL27902830 | 0.85 | CYP1A2 (0.74) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL773269 | 0.85 | NR2E1 (1.00) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL8539878 | 0.85 | CYP1A2 (0.73) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL9777763 | 0.85 | NR2E1 (1.00) | CYP1A2KDM4ECYP2C19MEN1KMT2A | |
| SCHEMBL9777869 | 0.85 | NR2E1 (1.00) | CYP1A2KDM4ECYP2C19MEN1KMT2A |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0643781-B1 | ELECTROCATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINIC COMPOUNDS | SEPRACOR INC (US) | 1998-06-24 | — | — | EP | claimed |
| EP-0643781-A1 | ELECTROCATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINIC COMPOUNDS | SEPRACOR, INC. (US) | 1995-03-22 | — | — | EP | claimed |
| WO-1993017150-A1 | ELECTROCATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINIC COMPOUNDS | SEPRACOR, INC. (US) | 1993-09-02 | — | — | WO | claimed |
| EP-0643781-B1 | ELECTROCATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINIC COMPOUNDS | SEPRACOR INC (US) | 1998-06-24 | — | — | EP | disclosed |
| US-5419817-A | Osmium tetroxide catalyst; preparing hydroxycarbonyl compounds from enol ether or vinyl halide | SEPRACOR INC. (US) | 1995-05-30 | — | — | US | disclosed |
| EP-0643781-A1 | ELECTROCATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINIC COMPOUNDS | SEPRACOR, INC. (US) | 1995-03-22 | — | — | EP | disclosed |
| US-5302257-A | Preparing optically active glycols using catalyst complex of osmium tetroxide and chiral oxidation resistant tertiary amine, employing secondary oxidant to generate osmium tetroxide, electrolytically regenerating secondary oxidant | SEPRACOR, INC. (US) | 1994-04-12 | — | — | US | disclosed |
| WO-1993017150-A1 | ELECTROCATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINIC COMPOUNDS | SEPRACOR, INC. (US) | 1993-09-02 | — | — | WO | disclosed |
| EP-0248879-A4 | SYNTHESIS OF ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES. | DU PONT (US) | 1990-02-26 | — | — | EP | disclosed |
| US-4900847-A | Catalytic asymmetric epoxidation | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1990-02-13 | — | — | US | disclosed |
| EP-0248879-A1 | SYNTHESIS OF ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-12-16 | — | — | EP | disclosed |
| WO-1987003583-A1 | SYNTHESIS OF ARYLOXYPROPANOLAMINES AND ARYLETHANOLAMINES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1987-06-18 | — | — | WO | disclosed |
| EP-0197766-A2 | Catalytic asymmetric epoxidation | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1986-10-15 | — | — | EP | disclosed |