Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| Piperazine SCHEMBL28816742 | 0.84 | ALDH1A1 (0.79) | ALDH1A1HTR2CTSHRGLAMAPK1 | |
| SCHEMBL28307564 | 0.84 | ALDH1A1 (0.59) | ALDH1A1HTR2CTSHR | |
| SCHEMBL28008564 | 0.84 | ALDH1A1 (0.52) | ALDH1A1HTR2CTSHRGLAMAPK1 | |
| Azetidine SCHEMBL28049251 | 0.81 | ALDH1A1 (0.79) | ALDH1A1HTR2CTSHRGLAMAPK1 | |
| SCHEMBL28018406 | 0.80 | ALDH1A1 (0.54) | ALDH1A1HTR2CTSHR | |
| SCHEMBL28274307 | 0.79 | TSHR (0.42) | HTR2CTSHRGLASLC6A2SLC6A3 | |
| SCHEMBL27791206 | 0.79 | TSHR (0.42) | HTR2CTSHRGLASLC6A2SLC6A3 | |
| SCHEMBL27939939 | 0.79 | TSHR (0.42) | HTR2CTSHRGLASLC6A2SLC6A3 | |
| Pyrrolidine SCHEMBL28053584 | 0.78 | ALDH1A1 (0.73) | ALDH1A1HTR2CTSHRGLAMAPK1 | |
| SCHEMBL28825695 | 0.77 | ALDH1A1 (0.67) | ALDH1A1HTR2CTSHRMAPK1L3MBTL1 |
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-103596960-B | 6, 7-dihydroimidazo [2,1-B ] [1,3] oxazine fungicides | 大塚制药株式会社 | 2016-11-16 | — | — | CN | disclosed |