Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 5/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9376548 | 0.92 | NLRP3 (0.39) | ALDH1A1SMN1; SMN2NLRP3PPARGGABRA1 | |
| SCHEMBL9372436 | 0.82 | NLRP3 (0.43) | ALDH1A1SMN1; SMN2NLRP3 | |
| SCHEMBL9368524 | 0.80 | NLRP3 (0.37) | ALDH1A1SMN1; SMN2NLRP3 | |
| SCHEMBL9368489 | 0.78 | DUSP3 (0.38) | ALDH1A1SMN1; SMN2GABRA1GABRG2GABRB3 | |
| SCHEMBL9374168 | 0.77 | NLRP3 (0.40) | ALDH1A1SMN1; SMN2NLRP3 | |
| SCHEMBL9369583 | 0.77 | NLRP3 (0.40) | ALDH1A1SMN1; SMN2NLRP3 | |
| SCHEMBL9372688 | 0.76 | F2 (0.40) | ALDH1A1SMN1; SMN2NLRP3CRHR1 | |
| SCHEMBL9481206 | 0.75 | HPGD (0.40) | ALDH1A1SMN1; SMN2NLRP3 | |
| SCHEMBL9368665 | 0.74 | PIN1 (0.47) | ALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL9368266 | 0.74 | NLRP3 (0.42) | ALDH1A1SMN1; SMN2NLRP3MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0377893-B1 | 3-Aryl-pyrrolidine-2,4-dione derivatives | BAYER AG (DE) | 1994-04-06 | — | — | EP | disclosed |
| US-5186737-A | Herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1993-02-16 | — | — | US | disclosed |
| US-5045560-A | Insecticides, nematocides, fungicides, herbicides, human and veterinary medicine | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-03 | — | — | US | disclosed |
| EP-0377893-A2 | 3-Aryl-pyrrolidine-2,4-dione derivatives | BAYER AG (DE) | 1990-07-18 | — | — | EP | disclosed |