Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.47 |
| ▸ | ERN1 | O75460 | 1/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4752052 | 0.88 | KMT2A (0.50) | KMT2AGAAHTTAGTR1MEN1 | |
| SCHEMBL16220186 | 0.83 | KMT2A (0.50) | KMT2AGAAHTTAGTR1MEN1 | |
| SCHEMBL11763129 | 0.82 | ALDH1A1 (0.49) | KMT2AMEN1ERN1ALDH1A1CYP3A4 | |
| SCHEMBL27616742 | 0.78 | RAD51 (0.62) | KMT2AGAAHTTMEN1ERN1 | |
| SCHEMBL5082436 | 0.78 | ERN1 (0.56) | KMT2AHTTERN1CA2CA5A | |
| SCHEMBL8866106 | 0.76 | KMT2A (0.57) | KMT2AGAAHTTAGTR1MEN1 | |
| SCHEMBL8866719 | 0.76 | KMT2A (0.53) | KMT2AGAAHTTAGTR1MEN1 | |
| SCHEMBL11861353 | 0.76 | HSD11B1 (0.62) | KMT2AGAAHTTAGTR1MEN1 | |
| SCHEMBL28226726 | 0.75 | CRHBP (0.52) | KMT2AGAAHTTAGTR1MEN1 | |
| SCHEMBL12903986 | 0.75 | KMT2A (0.56) | KMT2AGAAHTTAGTR1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106083665-B | A method of using aryl sulfonyl benzaldehyde hydrozone to cyclopropane compound open loop | 太原理工大学 | 2018-08-03 | — | — | CN | disclosed |
| CN-106083665-A | A kind of use the aryl sulfonyl benzaldehyde hydrozone method to cyclopropane compound open loop | 太原理工大学 | 2016-11-09 | — | — | CN | disclosed |