Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
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 | 0.81 | NLRP3 (0.39) | KMT2AALDH1A1LMNANLRP3MEN1 | |
| SCHEMBL9373305 | 0.77 | RORC (0.41) | KMT2AALDH1A1LMNANLRP3AKR1B1 | |
| SCHEMBL1429298 | 0.76 | AKR1B1 (0.55) | KMT2AALDH1A1LMNANLRP3AKR1B1 | |
| SCHEMBL9369590 | 0.75 | MAPK1 (0.43) | KMT2AALDH1A1NLRP3AKR1B1MEN1 | |
| SCHEMBL9368842 | 0.75 | NLRP3 (0.43) | KMT2AALDH1A1LMNANLRP3AKR1B1 | |
| SCHEMBL9481107 | 0.75 | NLRP3 (0.40) | KMT2AALDH1A1LMNANLRP3AKR1B1 | |
| Ammonia Solution, Strong SCHEMBL27532390 | 0.75 | AKR1B1 (0.53) | KMT2AALDH1A1LMNANLRP3AKR1B1 | |
| SCHEMBL9483535 | 0.75 | GAA (0.53) | KMT2AALDH1A1MEN1HTTGAA | |
| SCHEMBL9373260 | 0.73 | ITGB1 (0.39) | ALDH1A1NLRP3CRHR1MAPK1 | |
| SCHEMBL4432572 | 0.72 | CA12 (0.39) | ALDH1A1GAAALOX12CYP1A2CYP3A4 |
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 |