Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.34 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.33 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL2862271 | 0.90 | ALOX5 (0.38) | ALOX5POLBANPEPSLC1A3SLC1A2 | |
| Bicarbonate SCHEMBL10453278 | 0.84 | CYP1A2 (0.39) | ALOX5SLC1A3SLC1A2SLC1A1LMNA | |
| Acetone SCHEMBL254033 | 0.84 | ALOX5 (0.38) | ALOX5POLBALDH1A1TDP1LMNA | |
| Acetic Acid SCHEMBL27585871 | 0.82 | CYP1A2 (0.37) | ALOX5SLC1A3SLC1A2SLC1A1LMNA | |
| Bicarbonate SCHEMBL6470832 | 0.82 | CYP1A2 (0.42) | ALOX5LMNACYP2D6CYP1A2 | |
| Methyl Alcohol SCHEMBL21227036 | 0.81 | — | — | |
| SCHEMBL5691759 | 0.81 | CYP1A2 (0.41) | POLBALDH1A1TDP1CYP1A2TSHR | |
| SCHEMBL5684 | 0.81 | — | — | |
| Carbamic Acid SCHEMBL7781024 | 0.80 | ALOX5 (0.45) | ALOX5TDP1SLC1A3SLC1A2SLC1A1 | |
| Cyclohexane SCHEMBL28777359 | 0.80 | CYP1A2 (0.41) | ALOX5SLC1A3SLC1A2SLC1A1LMNA |
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-1311475-B1 | AMINOCYCLOHEXANE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-08-06 | — | — | EP | disclosed |