Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.58 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.58 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | CDC42 | P60953 | 1/20 | 0.58 |
| ▸ | RAC1 | P63000 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | RIOK2 | Q9BVS4 | 3/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL16186783 | 0.78 | PTGS2 (0.57) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL14921803 | 0.78 | PTGS2 (0.57) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL4815855 | 0.77 | KDM4E (0.53) | TSHRCYP1A2MAPT | |
| SCHEMBL11278320 | 0.75 | POLB (0.77) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| Naproxen SCHEMBL215236 | 0.74 | AKR1C3 (1.00) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| Naproxen SCHEMBL616149 | 0.74 | AKR1C3 (1.00) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL20887114 | 0.74 | PTGS2 (0.81) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| Naproxen SCHEMBL42434 | 0.74 | AKR1C3 (1.00) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL5534049 | 0.74 | PTGS2 (0.81) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL15116646 | 0.74 | PTGS2 (0.81) | PTGS2AKR1C3AKR1C2PTGS1TSHR |
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-2006138187-A1 | ENHANCED TISSUE PENETRATION PRODRUGS | WU YONG-QIAN (US) | 2006-12-28 | — | — | WO | disclosed |