Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.70 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.70 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.70 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.70 |
| ▸ | TSHR | P16473 | 2/20 | 0.70 |
| ▸ | CDC42 | P60953 | 1/20 | 0.70 |
| ▸ | RAC1 | P63000 | 1/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.70 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL30076171 | 0.86 | UGT2B7 (0.55) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL4808086 | 0.86 | UGT2B7 (0.55) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL1755267 | 0.86 | L3MBTL1 (0.58) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL6510993 | 0.85 | PTGS1 (0.56) | PTGS2PTGS1MAPTMEN1KMT2A | |
| Naproxen SCHEMBL23753934 | 0.84 | AKR1C3 (0.88) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| Naproxen SCHEMBL28881206 | 0.84 | AKR1C3 (0.88) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL9246980 | 0.83 | PTGS2 (0.63) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| SCHEMBL12090351 | 0.83 | PTGS2 (0.63) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| Naproxen SCHEMBL616149 | 0.83 | AKR1C3 (1.00) | PTGS2AKR1C3AKR1C2PTGS1TSHR | |
| Naproxen SCHEMBL3046 | 0.83 | AKR1C3 (1.00) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4142054-A | TRIVALENT THALLIUM SALT | THE UPJOHN COMPANY (US) | 1979-02-27 | — | — | US | disclosed |
| US-4135051-A | ENOL ETHER OF AN ARYL ALKYL KETONE WITH A THALLIJM SALT, REGENERATION OF THALLIUM SALT BY ADDING PERACID AND REACTIVE METAL COMPOUND | THE UPJOHN COMPANY (US) | 1979-01-16 | — | — | US | disclosed |
| US-4107439-A | Process for preparing arylalkanoic acid derivatives | THE UPJOHN COMPANY (US) | 1978-08-15 | — | — | US | disclosed |