Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL28019325 | 0.87 | LMNA (0.43) | L3MBTL1KDM4EKMT2AHPGDSMN1; SMN2 | |
| SCHEMBL28008233 | 0.85 | L3MBTL1 (0.41) | CES2CES1L3MBTL1KDM4EKMT2A | |
| SCHEMBL9095987 | 0.84 | CRHBP (0.38) | KMT2ASMN1; SMN2LMNACRHBPCRHR2 | |
| SCHEMBL1203167 | 0.84 | CRHBP (0.50) | CES2CES1L3MBTL1KDM4EKMT2A | |
| SCHEMBL1200534 | 0.81 | L3MBTL1 (0.37) | CES2CES1L3MBTL1KDM4EKMT2A | |
| SCHEMBL577685 | 0.78 | CES2 (0.44) | CES2CES1L3MBTL1KDM4EKMT2A | |
| SCHEMBL20490731 | 0.77 | ALDH1A1 (0.50) | CES2CES1L3MBTL1KMT2AHPGD | |
| SCHEMBL821889 | 0.76 | L3MBTL1 (0.44) | CES2CES1L3MBTL1KDM4EKMT2A | |
| SCHEMBL28008674 | 0.76 | KDM4E (0.49) | CES2CES1KDM4EKMT2AMEN1 | |
| SCHEMBL6242067 | 0.75 | HCAR2 (0.51) | CES2CES1L3MBTL1KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105072903-A | Use of substituted 1-(aryl ethynyl)-, 1-(heteroaryl ethynyl)-, 1-(heterocyclyl ethynyl)- and 1-(cyloalkenyl ethynyl)-cyclohexanols as active agents against abiotic plant stress | BAYER CROPSCIENCE AG | 2015-11-18 | — | — | CN | disclosed |