Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.48 |
| ▸ | CES1 | P23141 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10579805 | 0.92 | CES2 (0.55) | CES2CES1TSHRALOX15PTGS2 | |
| SCHEMBL29016164 | 0.92 | CES2 (0.55) | CES2CES1TSHRALOX15PTGS2 | |
| SCHEMBL25321662 | 0.85 | ALDH1A1 (0.56) | TSHRALOX15HSD17B10MAPK1BCL2L1 | |
| SCHEMBL9421060 | 0.85 | CES2 (0.43) | CES2CES1TSHRALOX15CA1 | |
| SCHEMBL9421070 | 0.85 | CES2 (0.43) | CES2CES1TSHRALOX15CA1 | |
| SCHEMBL11137766 | 0.81 | MAPT (0.51) | TSHRALOX15PTGS2L3MBTL1LMNA | |
| SCHEMBL12676349 | 0.81 | BCL2L1 (0.34) | CES2CES1TSHRALOX15CA1 | |
| SCHEMBL11137762 | 0.81 | MAPT (0.51) | TSHRALOX15PTGS2L3MBTL1LMNA | |
| SCHEMBL5077542 | 0.80 | ABCG2 (0.55) | TSHRCA1CA2CYP3A4LMNA | |
| SCHEMBL2559260 | 0.79 | CES2 (0.46) | CES2CES1TSHRALOX15CA1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104926629-B | Domino reaction is utilized to prepare the green method of 3,3-diaryl acrylic aldehyde | 江苏科本医药化学有限公司 | 2016-06-22 | — | — | CN | claimed |
| CN-104926629-A | Environment-friendly method for preparing 3,3-diaryl acrolein by utilizing domino reaction | JIANGSU COBEN PHARMACEUTICAL CO LTD | 2015-09-23 | — | — | CN | claimed |
| CN-104926629-B | Domino reaction is utilized to prepare the green method of 3,3-diaryl acrylic aldehyde | 江苏科本医药化学有限公司 | 2016-06-22 | — | — | CN | disclosed |
| CN-104926629-A | Environment-friendly method for preparing 3,3-diaryl acrolein by utilizing domino reaction | JIANGSU COBEN PHARMACEUTICAL CO LTD | 2015-09-23 | — | — | CN | disclosed |
| EP-0299379-B1 | PENTADIENAMIDE PAF-ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-21 | — | — | EP | disclosed |
| US-4975438-A | ANTICOAGULANT | HOFFMANN-LA ROCHE INC. (US) | 1990-12-04 | — | — | US | disclosed |
| EP-0299379-A1 | Pentadienamide PAF-antagonists | F. HOFFMANN-LA ROCHE AG (CH) | 1989-01-18 | — | — | EP | disclosed |
| US-4788206-A | CARDIOVASCULAR DISORDERS, PLATELETS | HOFFMANN-LA ROCHE INC. (US) | 1988-11-29 | — | — | US | disclosed |