Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | HAT1 | O14929 | 2/20 | 0.45 |
| ▸ | EP300 | Q09472 | 2/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7246014 | 0.89 | HDAC1 (0.50) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| Hydrochloric Acid SCHEMBL7251457 | 0.88 | F2 (0.48) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| SCHEMBL7244362 | 0.87 | HDAC6 (0.54) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| SCHEMBL7251622 | 0.87 | F2 (0.60) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| Hydrochloric Acid SCHEMBL7246548 | 0.86 | F2 (0.59) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| SCHEMBL7252107 | 0.82 | F2 (0.49) | HDAC6HDAC1F2HAT1EP300 | |
| SCHEMBL8029864 | 0.82 | ALDH1A1 (0.49) | HDAC6HDAC1ALDH1A1HSD17B10BCHE | |
| SCHEMBL6486632 | 0.81 | F2 (0.50) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| Hydrochloric Acid SCHEMBL7244675 | 0.80 | F2 (0.49) | HDAC6HDAC1ALDH1A1HSD17B10GAA | |
| SCHEMBL6475543 | 0.79 | KDM4E (0.48) | HDAC6HDAC1F2CNR2MAPT |
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-6512000-B1 | Aminocarbonyl- substituted benzimidazole derivatives for the treatment of diseases in which inhibition of tryptase is of therapeutic such as for treating an inflammatory or allergic disease | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2003-01-28 | — | — | US | disclosed |