Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 4/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | BAX | Q07812 | 1/20 | 0.46 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.43 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25026563 | 0.77 | SNCA (0.54) | LTA4HTSHRMAOBMAOAMEN1 | |
| SCHEMBL9217508 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL436010 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL3895815 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL3888963 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL3893288 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL9216135 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL3892308 | 0.76 | LTA4H (0.71) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL22129853 | 0.75 | LTA4H (0.92) | LTA4HTSHRMAOBMAOANR1H2 | |
| SCHEMBL3893562 | 0.75 | LTA4H (0.92) | LTA4HTSHRMAOBMAOANR1H2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0399293-B1 | PROCESS FOR PREPARING 2-CHLORO-4-NITRO-ALKYLBENZENE | BAYER AG (DE) | 1993-09-01 | — | — | EP | disclosed |
| US-5095157-A | Friedel-crafts catalyst | BAYER AKTIENGESELLSCHAFT (DE) | 1992-03-10 | — | — | US | disclosed |
| EP-0399293-A1 | Process for preparing 2-chloro-4-nitro-alkylbenzene | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |