Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 4/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27568201 | 0.94 | MEN1 (0.51) | CNR1MAOAMAOBCNR2MEN1 | |
| SCHEMBL28044003 | 0.88 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL13285509 | 0.78 | CYP2C19 (0.50) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL27711293 | 0.77 | APAF1 (0.56) | MEN1KMT2AALDH1A1SMN1; SMN2SLC6A2 | |
| SCHEMBL27711189 | 0.77 | APAF1 (0.56) | MEN1KMT2AALDH1A1SMN1; SMN2SLC6A2 | |
| SCHEMBL27711250 | 0.76 | CNR2 (0.51) | CNR1CNR2KMT2A | |
| SCHEMBL27604324 | 0.75 | CYP24A1 (0.55) | MEN1KMT2AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28095288 | 0.74 | MAPT (0.43) | CNR1MAOAMAOBCNR2MEN1 | |
| SCHEMBL9285815 | 0.74 | SMN1; SMN2 (0.56) | CNR1CNR2MEN1KMT2AALDH1A1 | |
| SCHEMBL9290103 | 0.73 | ALDH1A1 (0.49) | CNR1CNR2MEN1KMT2AALDH1A1 |
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-106243053-B | A kind of triazolylamide ketone fungicide, synthetic method and its application | 三峡大学 | 2018-09-28 | — | — | CN | disclosed |
| CN-106243053-A | A kind of triazolylamide ketone antibacterial, synthetic method and application thereof | 三峡大学 | 2016-12-21 | — | — | CN | disclosed |