Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 13/20 | 0.52 |
| ▸ | CES1 | P23141 | 11/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16390244 | 0.82 | POLB (0.63) | CES2CES1POLBRAB9AAKR1C3 | |
| SCHEMBL2387804 | 0.82 | CES2 (0.58) | CES2CES1POLBRAB9AAKR1C3 | |
| SCHEMBL8574337 | 0.77 | CES2 (0.78) | CES2CES1RAB9AAKR1C3 | |
| Benzil SCHEMBL9517636 | 0.72 | CES2 (1.00) | CES2CES1POLBRAB9ACA12 | |
| Benzil SCHEMBL28475956 | 0.72 | CES2 (1.00) | CES2CES1POLBRAB9ACA12 | |
| Benzil SCHEMBL7142843 | 0.72 | CES2 (1.00) | CES2CES1POLBRAB9ACA12 | |
| Benzil SCHEMBL2156589 | 0.72 | CES2 (1.00) | CES2CES1POLBRAB9ACA12 | |
| Benzil SCHEMBL66 | 0.72 | CES2 (1.00) | CES2CES1POLBRAB9ACA12 | |
| SCHEMBL29972427 | 0.71 | CES2 (0.67) | CES2CES1RAB9AAKR1C3 | |
| SCHEMBL7187335 | 0.71 | CES2 (0.67) | CES2CES1POLBAKR1C3CA12 |
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-4013620-A | OXIDATION RESISTANCE | AMERICAN CYANAMID COMPANY (US) | 1977-03-22 | — | — | US | disclosed |