Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 14/20 | 0.63 |
| ▸ | AKR1C2 | P52895 | 14/20 | 0.63 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | CDC42 | P60953 | 1/20 | 0.63 |
| ▸ | RAC1 | P63000 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.63 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL2600793 | 0.98 | AKR1C3 (0.65) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL11460825 | 0.98 | AKR1C3 (0.65) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL10041460 | 0.98 | AKR1C3 (0.65) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL11459076 | 0.93 | AKR1C3 (0.58) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL17369634 | 0.87 | AKR1C3 (0.53) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL15695568 | 0.87 | AKR1C3 (0.53) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL27634477 | 0.85 | CYP1A2 (0.50) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| Ammonia Solution, Strong SCHEMBL11721423 | 0.85 | AKR1C3 (0.67) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL11470486 | 0.83 | AKR1C3 (0.69) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 | |
| SCHEMBL14983577 | 0.82 | CYP1A2 (0.46) | AKR1C3AKR1C2PTGS2PTGS1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4048330-A | Compositions containing 2-(6'-substituted-2'-naphthyl)acetic acid esters used for treating inflammation, pain or pyrexia | SYNTEX CORPORATION (US) | 1977-09-13 | — | — | US | disclosed |
| US-4009197-A | 2-(6-Substituted-2'-naphthyl) acetic acid derivatives and the salts and esters thereof | SYNTEX CORPORATION (PM) | 1977-02-22 | — | — | US | disclosed |