Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.35 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.35 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.35 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.35 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.35 |
| ▸ | CACNG7 | P62955 | 1/20 | 0.35 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.35 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4426483 | 0.84 | CA2 (0.38) | TP53LMNAMAPTTHRB | |
| SCHEMBL7766420 | 0.76 | ALDH1A1 (0.35) | GAAALDH1A1HPGDHSD17B10LMNA | |
| SCHEMBL7780304 | 0.74 | TP53 (0.40) | GAATP53ALDH1A1KDM4EHPGD | |
| SCHEMBL4512633 | 0.73 | GAA (0.46) | GAATP53ALDH1A1KDM4EHPGD | |
| SCHEMBL14587466 | 0.73 | GAA (0.43) | GAATP53ALDH1A1KDM4EHPGD | |
| SCHEMBL12496757 | 0.72 | PDE7A (0.45) | GAATP53ALDH1A1HTT | |
| SCHEMBL8905942 | 0.72 | GAA (0.42) | GAATP53ALDH1A1KDM4EHPGD | |
| SCHEMBL4428134 | 0.71 | CRHBP (0.37) | ALDH1A1CACNA1BCACNB4CACNA1ACACNA1G | |
| SCHEMBL5231465 | 0.71 | SLC9A1 (0.41) | GAATP53CASP1CACNA1BCACNB4 | |
| SCHEMBL812654 | 0.70 | PGR (0.50) | — |
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-0613884-B1 | Dialkyl-1-H-3(2,4-dimethylphenyl)-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides | BAYER AG (DE) | 2001-06-20 | — | — | EP | disclosed |
| US-5602078-A | POSSESS HERBICIDAL AND PESTICIDAL ACTIVITY | BAYER AKTIENGESELLSCHAFT (DE) | 1997-02-11 | — | — | US | disclosed |
| US-5504057-A | HERBICIDES; PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-04-02 | — | — | US | disclosed |
| EP-0613884-A2 | Dialkyl-1-H-3(2,4-dimethylphenyl)-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides | BAYER AG (DE) | 1994-09-07 | — | — | EP | disclosed |