Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.30 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.30 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
| ▸ | CCR1 | P32246 | 1/20 | 0.30 |
| ▸ | CCR2 | P41597 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7781016 | 0.86 | DDB1 (0.36) | ALDH1A1CYP3A4DDB1CRBNL3MBTL1 | |
| SCHEMBL7780291 | 0.73 | CRBN (0.33) | DDB1CRBNL3MBTL1 | |
| SCHEMBL4433818 | 0.72 | CA2 (0.49) | ALDH1A1CYP3A4DDB1CRBN | |
| SCHEMBL6832132 | 0.71 | ALK (0.34) | ALDH1A1BACE1DDB1CRBN | |
| SCHEMBL7780304 | 0.69 | TP53 (0.40) | ALDH1A1BACE1L3MBTL1 | |
| SCHEMBL3596041 | 0.68 | KMT2A (0.33) | CRBN | |
| SCHEMBL24319159 | 0.67 | DDB1 (0.56) | DDB1CRBN | |
| SCHEMBL7778443 | 0.67 | CHRM2 (0.30) | — | |
| SCHEMBL6314284 | 0.66 | L3MBTL1 (0.34) | L3MBTL1 | |
| SCHEMBL1475659 | 0.65 | ALDH1A1 (0.33) | ALDH1A1DDB1CRBN |
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 |
|---|---|---|---|---|---|---|---|
| US-5847211-A | Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1998-12-08 | — | — | US | disclosed |
| EP-0668267-B1 | Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives | BAYER AG (DE) | 1998-04-08 | — | — | EP | disclosed |
| US-5622917-A | PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |
| EP-0668267-A1 | Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives | BAYER AG (DE) | 1995-08-23 | — | — | EP | disclosed |