Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2161738 | 0.75 | ALDH1A1 (0.47) | CES1FAAHDAGLAALDH1A1NPC1 | |
| SCHEMBL2161819 | 0.70 | CES1 (0.45) | CES1FAAHDAGLA | |
| SCHEMBL28331494 | 0.68 | CYP19A1 (0.62) | ALDH1A1NPC1TP53POLBRAB9A | |
| SCHEMBL2161996 | 0.68 | FAAH (0.47) | CES1FAAH | |
| SCHEMBL2162914 | 0.68 | DAGLA (0.49) | CES1FAAHDAGLAALDH1A1NPC1 | |
| SCHEMBL2162827 | 0.67 | FAAH (0.40) | CES1FAAH | |
| SCHEMBL2161989 | 0.65 | CES1 (0.61) | CES1FAAHDAGLAALDH1A1 | |
| SCHEMBL16038331 | 0.63 | ALDH1A1 (0.51) | ALDH1A1NPC1POLBRAB9A | |
| SCHEMBL4775723 | 0.63 | TRPA1 (0.57) | FAAH | |
| SCHEMBL6471773 | 0.63 | TRPA1 (0.57) | FAAH |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010005572-A2 | ALPHA-KETO HETEROCYCLES AS FAAH INHIBITORS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2010-01-14 | — | — | WO | disclosed |