Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | GRN | P28799 | 3/20 | 0.52 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | FPR2 | P25090 | 1/20 | 0.44 |
| ▸ | PYGL | P06737 | 1/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8556439 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPK1GRNSORT1LMNA | |
| SCHEMBL8651617 | 0.87 | TAS1R3 (0.52) | ALDH1A1 | |
| SCHEMBL8555232 | 0.87 | TAS1R3 (0.52) | ALDH1A1 | |
| SCHEMBL8553759 | 0.85 | KDM4E (0.45) | ALDH1A1CA1CA2KDM4E | |
| SCHEMBL8553756 | 0.85 | KDM4E (0.45) | ALDH1A1CA1CA2KDM4E | |
| SCHEMBL4435085 | 0.85 | PRSS1 (0.51) | ALDH1A1MAPK1GRNSORT1LMNA | |
| SCHEMBL4435087 | 0.85 | PRSS1 (0.51) | ALDH1A1MAPK1GRNSORT1LMNA | |
| SCHEMBL8556999 | 0.83 | SDCBP (0.47) | ALDH1A1MAPK1CA1CA2FPR2 | |
| SCHEMBL8556995 | 0.83 | SDCBP (0.47) | ALDH1A1MAPK1CA1CA2FPR2 | |
| SCHEMBL8557036 | 0.82 | MAPK1 (0.55) | ALDH1A1MAPK1GRNSORT1LMNA |
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 |