Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | TSPO | P30536 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4381746 | 0.77 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1KDM4EMAPK1NLRP3 | |
| SCHEMBL3813377 | 0.75 | GLP1R (0.33) | ALDH1A1KDM4ECASP1MAPTNPSR1 | |
| SCHEMBL10167562 | 0.71 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1KDM4EMAPK1NLRP3 | |
| SCHEMBL8134988 | 0.67 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1KDM4EMAPK1NLRP3 | |
| SCHEMBL3810911 | 0.65 | PARP1 (0.39) | ALDH1A1MAPK1MAPTPARP1TP53 | |
| SCHEMBL29464992 | 0.64 | CASP1 (0.40) | ALDH1A1L3MBTL1KDM4EMAPK1NLRP3 | |
| SCHEMBL4390046 | 0.63 | MAPT (0.39) | ALDH1A1L3MBTL1KDM4ENLRP3TSPO | |
| SCHEMBL11754921 | 0.63 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1KDM4EMAPK1NLRP3 | |
| SCHEMBL31167428 | 0.62 | CYP1A2 (0.51) | ALDH1A1L3MBTL1KDM4EMAPK1CYP1A2 | |
| SCHEMBL28455106 | 0.62 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1KDM4EMAPK1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009141065-A2 | (1,2-BENZISOTHIAZOL-3-YL)(THIO)CARBAMATES AND (1,2-BENZISOTHIAZOL-3-YL)(THIO)OXAMATES AND THE OXIDATION FORMS THEREOF FOR USE AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2009-11-26 | — | — | WO | disclosed |