Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL6273740 | 0.95 | LMNA (0.55) | CYP1B1MAOBLMNATSHRALOX12 | |
| SCHEMBL2342 | 0.89 | — | — | |
| SCHEMBL335864 | 0.89 | — | — | |
| Benzene SCHEMBL1225177 | 0.89 | MAOB (0.58) | MAOBLMNATSHRALDH1A1MAPT | |
| Benzene SCHEMBL1225180 | 0.89 | MAOB (0.58) | MAOBLMNATSHRALDH1A1MAPT | |
| SCHEMBL671163 | 0.89 | MAOB (0.58) | MAOBLMNATSHRALDH1A1MAPT | |
| SCHEMBL28967 | 0.89 | — | — | |
| SCHEMBL6009789 | 0.88 | ALDH1A1 (0.54) | CYP1B1LMNATSHRPPARGEGFR | |
| SCHEMBL840235 | 0.87 | NFE2L2 (0.56) | LMNATSHRACHEALDH1A1MAPT | |
| SCHEMBL272756 | 0.87 | NFE2L2 (0.56) | LMNATSHRACHEALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5338707-A | Reacting aluminum and silicon alkoxides in aromatic hydrocarbon solvent in hermetically sealed reactor, calcining product | INUI TOMOYUKI (JP) | 1994-08-16 | — | — | US | claimed |