Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 8/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 8/20 | 0.44 |
| ▸ | PTGIR | P43119 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5800538 | 0.93 | AKR1C3 (0.40) | AKR1C3AKR1C2LMNACYP1A2CYP2D6 | |
| SCHEMBL5801188 | 0.88 | AKR1C3 (0.39) | AKR1C3AKR1C2PTGIRLMNACYP1A2 | |
| SCHEMBL5554384 | 0.87 | AKR1C3 (0.41) | AKR1C3AKR1C2PTGIRLMNACYP1A2 | |
| SCHEMBL5558739 | 0.83 | AKR1C3 (0.57) | AKR1C3AKR1C2PTGIRLMNACYP1A2 | |
| SCHEMBL6425950 | 0.82 | AKR1C3 (0.40) | AKR1C3AKR1C2LMNACYP2C9TSHR | |
| SCHEMBL5798238 | 0.80 | AKR1C3 (0.48) | AKR1C3AKR1C2PTGIRLMNACYP1A2 | |
| SCHEMBL5553972 | 0.79 | AKR1C3 (0.39) | AKR1C3AKR1C2PTGIRLMNACYP1A2 | |
| SCHEMBL5798162 | 0.78 | AKR1C3 (0.47) | AKR1C3AKR1C2LMNACYP1A2CYP2D6 | |
| SCHEMBL5560517 | 0.77 | AKR1C3 (0.40) | AKR1C3AKR1C2PTGIRLMNACYP1A2 | |
| SCHEMBL5796936 | 0.77 | AKR1C3 (0.39) | AKR1C3AKR1C2LMNACYP1A2CYP2D6 |
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-2006050120-A2 | SYNTHESIS OF COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2006-05-11 | — | — | WO | disclosed |