Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7951790 | 0.92 | CSNK2A1 (0.50) | TRPA1NPC1RAB9ALMNACSNK2A1 | |
| SCHEMBL7941793 | 0.86 | CSNK2A1 (0.44) | TRPA1NPC1RAB9ALMNACHRM1 | |
| SCHEMBL686122 | 0.82 | TRPA1 (0.52) | TRPA1NPC1RAB9ATP53TDP1 | |
| SCHEMBL22078964 | 0.77 | TRPA1 (0.52) | TRPA1NPC1RAB9ATP53TDP1 | |
| SCHEMBL760290 | 0.77 | ALDH1A1 (0.57) | TRPA1NPC1RAB9ALMNACSNK2A1 | |
| SCHEMBL29495480 | 0.77 | ALDH1A1 (0.57) | TRPA1NPC1RAB9ALMNACSNK2A1 | |
| SCHEMBL7948005 | 0.77 | TRPA1 (0.52) | TRPA1NPC1RAB9ATP53TDP1 | |
| SCHEMBL14345562 | 0.76 | TRPA1 (0.50) | TRPA1NPC1RAB9ATP53TDP1 | |
| SCHEMBL11286832 | 0.76 | TRPA1 (0.50) | TRPA1NPC1RAB9ATP53TDP1 | |
| SCHEMBL11064533 | 0.76 | TRPA1 (0.50) | TRPA1NPC1RAB9ATP53TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111991441-A | Anti-inflammatory pharmaceutical composition and application thereof | 咸阳职业技术学院 | 2020-11-27 | — | — | CN | disclosed |
| US-6255517-B1 | 6-SULFONYLOXYISOPROPENYL-M-CRESOL AND ESTERS | Zee, Ok Pyo (KR) | 2001-07-03 | — | — | US | disclosed |