Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 10/20 | 0.44 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | CD44 | P16070 | 1/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10292489 | 0.81 | — | — | |
| SCHEMBL9511385 | 0.81 | AHR (0.60) | AHRFLT1 | |
| SCHEMBL38386558 | 0.81 | — | — | |
| SCHEMBL9508103 | 0.79 | CD44 (0.46) | CD44GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL9507665 | 0.79 | CD44 (0.46) | CD44GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL6466774 | 0.77 | AHR (0.68) | AHRFLT1CD44GRIN2DGRIN3B | |
| SCHEMBL32668930 | 0.77 | AHR (0.68) | AHRFLT1CD44GRIN2DGRIN3B | |
| SCHEMBL9510151 | 0.74 | AHR (0.44) | AHRFLT1ALDH1A1 | |
| SCHEMBL5859225 | 0.71 | GAA (0.44) | AHRFLT1MEN1ALDH1A1MAPT | |
| SCHEMBL5860599 | 0.71 | AHR (0.46) | AHRFLT1CYP3A4ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0173222-B1 | PROCESS FOR THE NUCLEAR CHLORINATION OF TOLUENE | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-03-09 | — | — | EP | disclosed |