Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17896182 | 1.00 | HTT (0.47) | HTTLMNAMAPK1ALDH1A1NPSR1 | |
| SCHEMBL20336627 | 0.86 | RCE1 (0.45) | HTTLMNAMAPK1ALDH1A1RCE1 | |
| SCHEMBL20336625 | 0.86 | RCE1 (0.45) | HTTLMNAMAPK1ALDH1A1RCE1 | |
| SCHEMBL17896161 | 0.78 | ATM (0.48) | MAPK1ALDH1A1NPSR1RCE1 | |
| SCHEMBL21440869 | 0.78 | ATM (0.48) | MAPK1ALDH1A1NPSR1RCE1 | |
| SCHEMBL28508515 | 0.78 | ATM (0.48) | MAPK1ALDH1A1NPSR1RCE1 | |
| SCHEMBL17900634 | 0.78 | CYP3A4 (0.43) | HTTLMNAMAPK1ALDH1A1NPSR1 | |
| SCHEMBL17895071 | 0.77 | CYP1A2 (0.40) | RCE1ACACBIDO1AGXTCYP1A2 | |
| SCHEMBL15013883 | 0.77 | RCE1 (0.54) | HTTLMNAMAPK1ALDH1A1RCE1 | |
| SCHEMBL875014 | 0.77 | RCE1 (0.54) | HTTLMNAMAPK1ALDH1A1RCE1 |
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-107205399-B | Picolinamides as fungicides | 美国陶氏益农公司 | 2021-01-29 | — | — | CN | disclosed |