Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.50 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | FABP2 | P12104 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23173084 | 0.88 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C4AKR1C1AKR1B10 | |
| SCHEMBL30180898 | 0.88 | ACHE (0.48) | AKR1C3AKR1C2MAPTESR2SMN1; SMN2 | |
| SCHEMBL6172557 | 0.88 | ACHE (0.48) | AKR1C3AKR1C2MAPTESR2SMN1; SMN2 | |
| SCHEMBL13703908 | 0.88 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C4AKR1C1AKR1B10 | |
| SCHEMBL19400433 | 0.88 | MEN1 (0.50) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL803238 | 0.86 | AKR1C3 (0.50) | AKR1C3AKR1C2AKR1C4AKR1C1AKR1B10 | |
| SCHEMBL15077185 | 0.86 | PTGS1 (0.49) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL2140807 | 0.86 | PTGS1 (0.49) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL28566500 | 0.86 | PTGS1 (0.49) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL10091190 | 0.85 | MAPT (0.49) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 |
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-2399585-A1 | Boronic acids and esters as inhibitors of fatty acid amide hydrolase | Infinity Pharmaceuticals, Inc. (US) | 2011-12-28 | — | — | EP | disclosed |