Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.57 |
| ▸ | CDC42 | P60953 | 1/20 | 0.57 |
| ▸ | RAC1 | P63000 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL490635 | 1.00 | PTGS2 (0.57) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL28329243 | 0.88 | CA12 (0.48) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL491187 | 0.86 | PTGS2 (0.61) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL31512445 | 0.86 | PTGS2 (0.61) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL2398222 | 0.85 | TP53 (0.46) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL28815671 | 0.83 | PTGS2 (0.46) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL25255901 | 0.83 | PTGS2 (0.50) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL7960349 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL28282836 | 0.83 | PTGS2 (0.57) | PTGS2PTGS1AKR1C3AKR1C2CDC42 | |
| SCHEMBL8639782 | 0.82 | NPC1 (0.54) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112682031-B | Oil field interwell tracer, tracing method and fracturing fluid | 中国石油化工股份有限公司 | 2024-06-28 | — | — | CN | disclosed |