Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.41 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL140117 | 1.00 | PTGS2 (0.48) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| SCHEMBL310988 | 0.98 | PTGS2 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| SCHEMBL14740337 | 0.98 | PTGS2 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL27951368 | 0.98 | PTGS2 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| Water SCHEMBL15672826 | 0.96 | PTGS2 (0.46) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| Water SCHEMBL30526228 | 0.96 | PTGS2 (0.50) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| SCHEMBL8597480 | 0.94 | PTGS2 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| SCHEMBL15849847 | 0.94 | PTGS2 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| SCHEMBL29743050 | 0.93 | CASP1 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 | |
| SCHEMBL232659 | 0.93 | CASP1 (0.47) | PTGS2SMN1; SMN2TSHRHSD17B10ALDH1A1 |
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-109718376-B | Ophthalmic product with anti-allergy and relieving effects | 晶硕光学股份有限公司 | 2022-01-25 | — | — | CN | disclosed |